U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C16H16ClNO4S
Molecular Weight 353.821
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DALTROBAN

SMILES

OC(=O)CC1=CC=C(CCNS(=O)(=O)C2=CC=C(Cl)C=C2)C=C1

InChI

InChIKey=IULOBWFWYDMECP-UHFFFAOYSA-N
InChI=1S/C16H16ClNO4S/c17-14-5-7-15(8-6-14)23(21,22)18-10-9-12-1-3-13(4-2-12)11-16(19)20/h1-8,18H,9-11H2,(H,19,20)

HIDE SMILES / InChI
Daltroban (also known as BM 13505, SKF 96148), a specific thromboxane A2 receptor antagonist, was studied as an antithrombotic agent. The drug was licensed to Smith Kline Beecham, underwent phase III clinical trials in the UK and Germany as an antithrombotic agent but did not enter clinical trials in the USA. Besides, вaltroban was investigated in patients with an ischemic heart disorder. However, the development of daltroban has been discontinued.

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
37.1 nM [IC50]
PubMed

PubMed

TitleDatePubMed
Protective effect of the specific thromboxane receptor antagonist, BM-13505, in reperfusion injury following acute myocardial ischemia in cats.
1989 Apr
Effects of KW-3635, a novel dibenzoxepin derivative of a selective thromboxane A2 antagonist, on human, guinea pig and rat platelets.
1992 Jul
Antithrombotic effects in a rat model of aspirin-insensitive arterial thrombosis of desethyl KBT-3022, the main active metabolite of a new antiplatelet agent, KBT-3022.
1997 Jun 11

Sample Use Guides

10 healthy volunteers were given 400 mg p.o., the terminal half-life was 7 h,
Route of Administration: Oral
Name Type Language
DALTROBAN
INN   MI   USAN  
INN   USAN  
Official Name English
BENZENEACETIC ACID, 4-(2-(((4-CHLOROPHENYL)SULFONYL)AMINO)ETHYL)-
Systematic Name English
DALTROBAN [MI]
Common Name English
BM-13505
Code English
DALTROBAN [USAN]
Common Name English
BM13505
Code English
SKF96148
Code English
(P-(2-(P-CHLOROBENZENESULFONAMIDO)ETHYL)PHENYL)ACETIC ACID
Systematic Name English
daltroban [INN]
Common Name English
SKF-96148
Code English
Code System Code Type Description
NCI_THESAURUS
C169873
Created by admin on Sat Dec 16 16:56:23 GMT 2023 , Edited by admin on Sat Dec 16 16:56:23 GMT 2023
PRIMARY
USAN
BB-44
Created by admin on Sat Dec 16 16:56:23 GMT 2023 , Edited by admin on Sat Dec 16 16:56:23 GMT 2023
PRIMARY
SMS_ID
100000083996
Created by admin on Sat Dec 16 16:56:23 GMT 2023 , Edited by admin on Sat Dec 16 16:56:23 GMT 2023
PRIMARY
EVMPD
SUB06893MIG
Created by admin on Sat Dec 16 16:56:23 GMT 2023 , Edited by admin on Sat Dec 16 16:56:23 GMT 2023
PRIMARY
CAS
79094-20-5
Created by admin on Sat Dec 16 16:56:23 GMT 2023 , Edited by admin on Sat Dec 16 16:56:23 GMT 2023
PRIMARY
INN
6061
Created by admin on Sat Dec 16 16:56:23 GMT 2023 , Edited by admin on Sat Dec 16 16:56:23 GMT 2023
PRIMARY
PUBCHEM
54343
Created by admin on Sat Dec 16 16:56:23 GMT 2023 , Edited by admin on Sat Dec 16 16:56:23 GMT 2023
PRIMARY
MERCK INDEX
m4075
Created by admin on Sat Dec 16 16:56:23 GMT 2023 , Edited by admin on Sat Dec 16 16:56:23 GMT 2023
PRIMARY Merck Index
FDA UNII
S25VDY08ZC
Created by admin on Sat Dec 16 16:56:23 GMT 2023 , Edited by admin on Sat Dec 16 16:56:23 GMT 2023
PRIMARY
EPA CompTox
DTXSID6046501
Created by admin on Sat Dec 16 16:56:23 GMT 2023 , Edited by admin on Sat Dec 16 16:56:23 GMT 2023
PRIMARY
ChEMBL
CHEMBL71685
Created by admin on Sat Dec 16 16:56:23 GMT 2023 , Edited by admin on Sat Dec 16 16:56:23 GMT 2023
PRIMARY