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

Details

Stereochemistry ACHIRAL
Molecular Formula C22H24ClN5O
Molecular Weight 409.912
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BALOVAPTAN

SMILES

CN1CC2=NN=C([C@H]3CC[C@@H](CC3)OC4=NC=CC=C4)N2C5=CC=C(Cl)C=C5C1

InChI

InChIKey=GMPZPHGHNDMRKL-RZDIXWSQSA-N
InChI=1S/C22H24ClN5O/c1-27-13-16-12-17(23)7-10-19(16)28-20(14-27)25-26-22(28)15-5-8-18(9-6-15)29-21-4-2-3-11-24-21/h2-4,7,10-12,15,18H,5-6,8-9,13-14H2,1H3/t15-,18-

HIDE SMILES / InChI

Molecular Formula C22H24ClN5O
Molecular Weight 409.912
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:17:05 GMT 2023
Edited
by admin
on Sat Dec 16 09:17:05 GMT 2023
Record UNII
RAX5D5AGV6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BALOVAPTAN
INN  
USAN   INN  
Official Name English
BALOVAPTAN [USAN]
Common Name English
8-CHLORO-5-METHYL-1-(TRANS-4-(PYRIDIN-2-YLOXY)CYCLOHEXYL)-5,6-DIHYDRO-4H-(1,2,4)TRIAZOLO(4,3-A)(1,4)BENZODIAZEPINE
Systematic Name English
Balovaptan [WHO-DD]
Common Name English
RG7314
Code English
RG-7314
Code English
4H-(1,2,4)TRIAZOLO(4,3-A)(1,4)BENZODIAZEPINE, 8-CHLORO-5,6-DIHYDRO-5-METHYL-1-(TRANS-4-(2-PYRIDINYLOXY)CYCLOHEXYL)-
Systematic Name English
balovaptan [INN]
Common Name English
RO-5285119
Code English
RO5285119
Code English
Code System Code Type Description
SMS_ID
300000020932
Created by admin on Sat Dec 16 09:17:05 GMT 2023 , Edited by admin on Sat Dec 16 09:17:05 GMT 2023
PRIMARY
INN
10298
Created by admin on Sat Dec 16 09:17:05 GMT 2023 , Edited by admin on Sat Dec 16 09:17:05 GMT 2023
PRIMARY
DRUG BANK
DB14823
Created by admin on Sat Dec 16 09:17:05 GMT 2023 , Edited by admin on Sat Dec 16 09:17:05 GMT 2023
PRIMARY
FDA UNII
RAX5D5AGV6
Created by admin on Sat Dec 16 09:17:05 GMT 2023 , Edited by admin on Sat Dec 16 09:17:05 GMT 2023
PRIMARY
USAN
EG-68
Created by admin on Sat Dec 16 09:17:05 GMT 2023 , Edited by admin on Sat Dec 16 09:17:05 GMT 2023
PRIMARY
NCI_THESAURUS
C169802
Created by admin on Sat Dec 16 09:17:05 GMT 2023 , Edited by admin on Sat Dec 16 09:17:05 GMT 2023
PRIMARY
EPA CompTox
DTXSID101107286
Created by admin on Sat Dec 16 09:17:05 GMT 2023 , Edited by admin on Sat Dec 16 09:17:05 GMT 2023
PRIMARY
PUBCHEM
46200932
Created by admin on Sat Dec 16 09:17:05 GMT 2023 , Edited by admin on Sat Dec 16 09:17:05 GMT 2023
PRIMARY
CAS
1228088-30-9
Created by admin on Sat Dec 16 09:17:05 GMT 2023 , Edited by admin on Sat Dec 16 09:17:05 GMT 2023
PRIMARY
WIKIPEDIA
Balovaptan
Created by admin on Sat Dec 16 09:17:05 GMT 2023 , Edited by admin on Sat Dec 16 09:17:05 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY