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Details

Stereochemistry ACHIRAL
Molecular Formula C18H18ClN3O.ClH
Molecular Weight 364.269
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BMS-823778

SMILES

Cl.CC(C)(O)C1=CC=CN2C1=NN=C2C3(CC3)C4=CC=C(Cl)C=C4

InChI

InChIKey=MQBBSMNIRWXALO-UHFFFAOYSA-N
InChI=1S/C18H18ClN3O.ClH/c1-17(2,23)14-4-3-11-22-15(14)20-21-16(22)18(9-10-18)12-5-7-13(19)8-6-12;/h3-8,11,23H,9-10H2,1-2H3;1H

HIDE SMILES / InChI

Molecular Formula C18H18ClN3O
Molecular Weight 327.808
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
Target ID: P28845
Gene ID: 3290.0
Gene Symbol: HSD11B1
Target Organism: Homo sapiens (Human)
Substance Class Chemical
Created
by admin
on Sat Dec 16 01:27:29 GMT 2023
Edited
by admin
on Sat Dec 16 01:27:29 GMT 2023
Record UNII
C82R061MZ5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BMS-823778
Code English
1,2,4-TRIAZOLO(4,3-A)PYRIDINE-8-METHANOL, 3-(1-(4-CHLOROPHENYL)CYCLOPROPYL)-.ALPHA.,.ALPHA.-DIMETHYL-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
CAS
1140898-87-8
Created by admin on Sat Dec 16 01:27:29 GMT 2023 , Edited by admin on Sat Dec 16 01:27:29 GMT 2023
PRIMARY
FDA UNII
C82R061MZ5
Created by admin on Sat Dec 16 01:27:29 GMT 2023 , Edited by admin on Sat Dec 16 01:27:29 GMT 2023
PRIMARY
CAS
1707292-81-6
Created by admin on Sat Dec 16 01:27:29 GMT 2023 , Edited by admin on Sat Dec 16 01:27:29 GMT 2023
NO STRUCTURE GIVEN
PUBCHEM
54669979
Created by admin on Sat Dec 16 01:27:29 GMT 2023 , Edited by admin on Sat Dec 16 01:27:29 GMT 2023
PRIMARY