Chemical ID: 4815613

Cc1c2c([nH]n1)OC(=C(C2c3cn(nc3c4ccccc4)CC(=O)N)C#N)N
Chemical ID:
4815613
Name [?]:
2-[4-(4-amino-3-cyano-9-methyl-5-oxa-7,8-diazabicyclo[4.3.0]nona-3,8,10-trien-2-yl)-3-phenyl-pyrazol-1-yl]acetamide
SMILES [?]:
Cc1c2c([nH]n1)OC(=C(C2c3cn(nc3c4ccccc4)CC(=O)N)C#N)N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H17N7O2
All Atoms:28
Heavy Atoms:28
Chiral Atoms:1
ZAP Information [?]
Total:8.08372
Area:557.466
Solvation:-5.85292
Coulombic:-64.3799
Bond Count [?]
All:31
Single:21
Double:9
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:375.384
H-Bond Donors:4
H-Bond Acceptors:5
XLogP:1.62
LogP (Chemaxon):0.71

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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