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

Details

Stereochemistry ACHIRAL
Molecular Formula C19H28Cl2N4O2.ClH
Molecular Weight 451.818
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TINOSTAMUSTINE HYDROCHLORIDE

SMILES

Cl.CN1C(CCCCCCC(=O)NO)=NC2=CC(=CC=C12)N(CCCl)CCCl

InChI

InChIKey=DWGQFQRWFYIINU-UHFFFAOYSA-N
InChI=1S/C19H28Cl2N4O2.ClH/c1-24-17-9-8-15(25(12-10-20)13-11-21)14-16(17)22-18(24)6-4-2-3-5-7-19(26)23-27;/h8-9,14,27H,2-7,10-13H2,1H3,(H,23,26);1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C19H28Cl2N4O2
Molecular Weight 415.357
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
6.0 nM [IC50]
9.0 nM [IC50]
9.0 nM [IC50]
25.0 nM [IC50]
PubMed

PubMed

TitleDatePubMed
The Alkylating-HDAC Inhibition Fusion Principle: Taking Chemotherapy to the Next Level with the First in Class Molecule EDO-S101.
2016
Substance Class Chemical
Created
by admin
on Wed Apr 02 01:33:13 GMT 2025
Edited
by admin
on Wed Apr 02 01:33:13 GMT 2025
Record UNII
QK4ZBS4FPO
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-DESBUTYLCARBOXY-2-(N-HYDROXYHEPTANAMINO) BENDAMUSTINE HYDROCHLORIDE
Preferred Name English
TINOSTAMUSTINE HYDROCHLORIDE
Common Name English
1H-BENZIMIDAZOLE-2-HEPTANAMIDE, 5-(BIS(2-CHLOROETHYL)AMINO)-N-HYDROXY-1-METHYL-, HYDROCHLORIDE (1:1)
Systematic Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 634018
Created by admin on Wed Apr 02 01:33:13 GMT 2025 , Edited by admin on Wed Apr 02 01:33:13 GMT 2025
FDA ORPHAN DRUG 636418
Created by admin on Wed Apr 02 01:33:13 GMT 2025 , Edited by admin on Wed Apr 02 01:33:13 GMT 2025
Code System Code Type Description
FDA UNII
QK4ZBS4FPO
Created by admin on Wed Apr 02 01:33:13 GMT 2025 , Edited by admin on Wed Apr 02 01:33:13 GMT 2025
PRIMARY
CAS
1793059-58-1
Created by admin on Wed Apr 02 01:33:13 GMT 2025 , Edited by admin on Wed Apr 02 01:33:13 GMT 2025
PRIMARY
EVMPD
SUB195194
Created by admin on Wed Apr 02 01:33:13 GMT 2025 , Edited by admin on Wed Apr 02 01:33:13 GMT 2025
PRIMARY
SMS_ID
100000181505
Created by admin on Wed Apr 02 01:33:13 GMT 2025 , Edited by admin on Wed Apr 02 01:33:13 GMT 2025
PRIMARY
PUBCHEM
134687437
Created by admin on Wed Apr 02 01:33:13 GMT 2025 , Edited by admin on Wed Apr 02 01:33:13 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY