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Details

Stereochemistry ABSOLUTE
Molecular Formula C25H25Cl2FN6O3
Molecular Weight 547.409
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of X-376

SMILES

C[C@@H](OC1=CC(=NN=C1N)C(=O)NC2=CC=C(C=C2)C(=O)N3CCN(C)CC3)C4=C(Cl)C=CC(F)=C4Cl

InChI

InChIKey=ONPGOSVDVDPBCY-CQSZACIVSA-N
InChI=1S/C25H25Cl2FN6O3/c1-14(21-17(26)7-8-18(28)22(21)27)37-20-13-19(31-32-23(20)29)24(35)30-16-5-3-15(4-6-16)25(36)34-11-9-33(2)10-12-34/h3-8,13-14H,9-12H2,1-2H3,(H2,29,32)(H,30,35)/t14-/m1/s1

HIDE SMILES / InChI

Molecular Formula C25H25Cl2FN6O3
Molecular Weight 547.409
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:06:28 UTC 2023
Edited
by admin
on Sat Dec 16 08:06:28 UTC 2023
Record UNII
7DR7JMB8BH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
X-376
Common Name English
(R)-6-AMINO-5-(1-(2,6-DICHLORO-3-FLUOROPHENYL)ETHOXY)-N-(4-(4-METHYLPIPERAZINE-1-CARBONYL)PHENYL)PYRIDAZINE-3-CARBOXAMIDE
Systematic Name English
3-PYRIDAZINECARBOXAMIDE, 6-AMINO-5-((1R)-1-(2,6-DICHLORO-3-FLUOROPHENYL)ETHOXY)-N-(4-((4-METHYL-1-PIPERAZINYL)CARBONYL)PHENYL)-
Systematic Name English
Code System Code Type Description
CAS
1365267-27-1
Created by admin on Sat Dec 16 08:06:29 UTC 2023 , Edited by admin on Sat Dec 16 08:06:29 UTC 2023
PRIMARY
PUBCHEM
56960447
Created by admin on Sat Dec 16 08:06:29 UTC 2023 , Edited by admin on Sat Dec 16 08:06:29 UTC 2023
PRIMARY
ChEMBL
CHEMBL3544934
Created by admin on Sat Dec 16 08:06:29 UTC 2023 , Edited by admin on Sat Dec 16 08:06:29 UTC 2023
PRIMARY
FDA UNII
7DR7JMB8BH
Created by admin on Sat Dec 16 08:06:29 UTC 2023 , Edited by admin on Sat Dec 16 08:06:29 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
INHIBITOR
IC50
TARGET -> INHIBITOR
INHIBITOR
IC50
Related Record Type Details
ACTIVE MOIETY