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Details

Stereochemistry ABSOLUTE
Molecular Formula C42H57ClN4O5S
Molecular Weight 765.444
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MURIZATOCLAX

SMILES

CO[C@]3(CN1CC[N@]2CCCC[C@@H]2C1)\C=C\C[C@H](C)[C@@H](C)S(=O)(=O)NC(=O)C4=CC5=C(OC[C@]6(CCCC7=C6C=CC(Cl)=C7)CN5C[C@@H]8CC[C@@H]38)C=C4

InChI

InChIKey=BJTFTQIBRVBSBH-VCQPVEJUSA-N
InChI=1S/C42H57ClN4O5S/c1-29-8-6-18-42(51-3,27-45-20-21-46-19-5-4-10-35(46)25-45)37-14-11-33(37)24-47-26-41(17-7-9-31-22-34(43)13-15-36(31)41)28-52-39-16-12-32(23-38(39)47)40(48)44-53(49,50)30(29)2/h6,12-13,15-16,18,22-23,29-30,33,35,37H,4-5,7-11,14,17,19-21,24-28H2,1-3H3,(H,44,48)/b18-6+/t29-,30+,33-,35+,37+,41-,42-/m0/s1

HIDE SMILES / InChI

Molecular Formula C42H57ClN4O5S
Molecular Weight 765.444
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:05:17 UTC 2023
Edited
by admin
on Sat Dec 16 14:05:17 UTC 2023
Record UNII
BO0V7196L2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MURIZATOCLAX
INN   USAN  
Official Name English
(13S,31R,32R,4R,5E,8S,9R)-6'-CHLORO-4-METHOXY-8,9-DIMETHYL-4-(((9AR)- OCTAHYDRO-2H-PYRIDO(1,2-A)PYRAZIN-2-YL)METHYL)-3',4'-DIHYDRO-12H,14H,2'HSPIRO( 10.LAMBDA.6-THIA-11-AZA-1(5,7)-(1,5)BENZOXAZEPINA-3(1,2)- CYCLOBUTANACYCLODODECAPHAN-5-ENE-13,1'-NAPHTHAL
Systematic Name English
SPIRO(5,7-ETHENO-1H,11H-CYCLOBUT(I)(1,4)OXAZEPINO(3,4-F)(1,2,7)THIADIAZACYCLOHEXADECINE-2(3H),1'(2'H)-NAPHTHALEN)-8(9H)-ONE, 6'-CHLORO-3',4',12,13,16,16A,17,18,18A,19-DECAHYDRO-16-METHOXY-11,12-DIMETHYL-16-(((9AR)-OCTAHYDRO-2H-PYRIDO(1,2-A)PYRAZIN-2-YL)M
Systematic Name English
MURIZATOCLAX [USAN]
Common Name English
Murizatoclax [WHO-DD]
Common Name English
AMG-397
Code English
murizatoclax [INN]
Common Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 675018
Created by admin on Sat Dec 16 14:05:17 UTC 2023 , Edited by admin on Sat Dec 16 14:05:17 UTC 2023
FDA ORPHAN DRUG 698019
Created by admin on Sat Dec 16 14:05:17 UTC 2023 , Edited by admin on Sat Dec 16 14:05:17 UTC 2023
FDA ORPHAN DRUG 674818
Created by admin on Sat Dec 16 14:05:17 UTC 2023 , Edited by admin on Sat Dec 16 14:05:17 UTC 2023
Code System Code Type Description
PUBCHEM
138669688
Created by admin on Sat Dec 16 14:05:17 UTC 2023 , Edited by admin on Sat Dec 16 14:05:17 UTC 2023
PRIMARY
NCI_THESAURUS
C156740
Created by admin on Sat Dec 16 14:05:17 UTC 2023 , Edited by admin on Sat Dec 16 14:05:17 UTC 2023
PRIMARY
USAN
HI-235
Created by admin on Sat Dec 16 14:05:17 UTC 2023 , Edited by admin on Sat Dec 16 14:05:17 UTC 2023
PRIMARY
SMS_ID
300000024168
Created by admin on Sat Dec 16 14:05:17 UTC 2023 , Edited by admin on Sat Dec 16 14:05:17 UTC 2023
PRIMARY
CAS
2245848-05-7
Created by admin on Sat Dec 16 14:05:17 UTC 2023 , Edited by admin on Sat Dec 16 14:05:17 UTC 2023
PRIMARY
FDA UNII
BO0V7196L2
Created by admin on Sat Dec 16 14:05:17 UTC 2023 , Edited by admin on Sat Dec 16 14:05:17 UTC 2023
PRIMARY
INN
11281
Created by admin on Sat Dec 16 14:05:17 UTC 2023 , Edited by admin on Sat Dec 16 14:05:17 UTC 2023
PRIMARY
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IC50
TRANSPORTER -> SUBSTRATE
Efflux ratio of 100 at 1μM versus 4 with Pg-p inhibitor
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