Chemical ID: 3951326

Cc1ccc2c(c1)N(C(=O)C(O2)C)CC(=O)N3CCN(CC3)c4ccccc4
Chemical ID:
3951326
Name [?]:
3,8-dimethyl-5-[(4-phenylpiperazin-1-yl)carbonylmethyl]-2-oxa-5-azabicyclo[4.4.0]deca-7,9,11-trien-4-one
SMILES [?]:
Cc1ccc2c(c1)N(C(=O)C(O2)C)CC(=O)N3CCN(CC3)c4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H25N3O3
All Atoms:28
Heavy Atoms:28
Chiral Atoms:1
ZAP Information [?]
Total:9.75303
Area:587.031
Solvation:-4.92273
Coulombic:-48.0029
Bond Count [?]
All:31
Single:23
Double:8
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:379.452
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:2.88
LogP (Chemaxon):2.73

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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