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Details

Stereochemistry ABSOLUTE
Molecular Formula C29H38N4O
Molecular Weight 458.6382
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TAK-075 FREE BASE

SMILES

CCC1=CC=C(C=C1)C(CC)(CC)NC(=O)C2=C3N[C@H](CC(C)(C)N3N=C2C)C4=CC=CC=C4

InChI

InChIKey=UEEHORXWFOHMHK-XMMPIXPASA-N
InChI=1S/C29H38N4O/c1-7-21-15-17-23(18-16-21)29(8-2,9-3)31-27(34)25-20(4)32-33-26(25)30-24(19-28(33,5)6)22-13-11-10-12-14-22/h10-18,24,30H,7-9,19H2,1-6H3,(H,31,34)/t24-/m1/s1

HIDE SMILES / InChI

Molecular Formula C29H38N4O
Molecular Weight 458.6382
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 14:05:40 GMT 2023
Edited
by admin
on Sat Dec 16 14:05:40 GMT 2023
Record UNII
4B002AUC52
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TAK-075 FREE BASE
Code English
PYRAZOLO(1,5-A)PYRIMIDINE-3-CARBOXAMIDE, N-(1-ETHYL-1-(4-ETHYLPHENYL)PROPYL)-4,5,6,7-TETRAHYDRO-2,7,7-TRIMETHYL-5-PHENYL-, (5R)-
Systematic Name English
Code System Code Type Description
PUBCHEM
135565656
Created by admin on Sat Dec 16 14:05:40 GMT 2023 , Edited by admin on Sat Dec 16 14:05:40 GMT 2023
PRIMARY
CAS
667931-25-1
Created by admin on Sat Dec 16 14:05:40 GMT 2023 , Edited by admin on Sat Dec 16 14:05:40 GMT 2023
PRIMARY
FDA UNII
4B002AUC52
Created by admin on Sat Dec 16 14:05:40 GMT 2023 , Edited by admin on Sat Dec 16 14:05:40 GMT 2023
PRIMARY
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