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1017241-34-7,MFCD21363737
Catalog No.:AA00058U

1017241-34-7 | 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(4-methyl-1-piperazinyl)-3-(2-oxopropylidene)-, (3Z)-

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Technical Information
Catalog Number:
AA00058U
Chemical Name:
2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(4-methyl-1-piperazinyl)-3-(2-oxopropylidene)-, (3Z)-
CAS Number:
1017241-34-7
Molecular Formula:
C17H20N4O2
Molecular Weight:
312.3663
MDL Number:
MFCD21363737
SMILES:
CN1CCN(CC1)c1nc2ccccc2[nH]c(=O)/c/1=C\C(=O)C
Properties
Computed Properties
 
Complexity:
702  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
0.8  

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Tags:1017241-34-7 Molecular Formula|1017241-34-7 MDL|1017241-34-7 SMILES|1017241-34-7 2H-1,5-Benzodiazepin-2-one, 1,3-dihydro-4-(4-methyl-1-piperazinyl)-3-(2-oxopropylidene)-, (3Z)-