Chemical ID: 4695450

CC(C)NC(=O)c1cc2n(n1)CCN(C2=O)Cc3ccc(cc3)OC
Chemical ID:
4695450
Name [?]:
N-isopropyl-3-[(4-methoxyphenyl)methyl]-2-oxo-3,6,7-triazabicyclo[4.3.0]nona-7,9-diene-8-carboxamide
SMILES [?]:
CC(C)NC(=O)c1cc2n(n1)CCN(C2=O)Cc3ccc(cc3)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H22N4O3
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:9.92375
Area:562.446
Solvation:-4.13741
Coulombic:-52.6566
Bond Count [?]
All:27
Single:20
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:342.392
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:1.78
LogP (Chemaxon):0.63

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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