Chemical ID: 4104908

COc1ccc(cc1)NC(=O)CC2C(=O)N3CCN=C3S2
Chemical ID:
4104908
Name [?]:
N-(4-methoxyphenyl)-2-(8-oxo-6-thia-1,4-diazabicyclo[3.3.0]oct-4-en-7-yl)-acetamide
SMILES [?]:
COc1ccc(cc1)NC(=O)CC2C(=O)N3CCN=C3S2
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H15N3O3S
All Atoms:21
Heavy Atoms:21
Chiral Atoms:1
ZAP Information [?]
Total:7.38775
Area:490.133
Solvation:-4.86557
Coulombic:-47.073
Bond Count [?]
All:23
Single:17
Double:6
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:305.353
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:0.11
LogP (Chemaxon):1.34

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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