Chemical ID: 3930394

Cc1c(sc2c1c(=O)[nH]c(n2)CN(CCc3ccccc3)C(=O)c4ccco4)C
Chemical ID:
3930394
Name [?]:
N-[(7,8-dimethyl-5-oxo-9-thia-2,4-diazabicyclo[4.3.0]nona-2,7,10-trien-3-yl)methyl]-N-phenethyl-furan-2-carboxamide
SMILES [?]:
Cc1c(sc2c1c(=O)[nH]c(n2)CN(CCc3ccccc3)C(=O)c4ccco4)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H21N3O3S
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:12.1177
Area:619.449
Solvation:-3.36851
Coulombic:-53.9297
Bond Count [?]
All:32
Single:22
Double:10
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:407.487
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:1.88
LogP (Chemaxon):3.34

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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