Chemical ID: 3856955

Cc1ccc2cc(c(=O)[nH]c2c1C)CN(C3CCCC3)C(=S)Nc4ccc(cc4)OC
Chemical ID:
3856955
Name [?]:
1-cyclopentyl-1-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)-thiourea
SMILES [?]:
Cc1ccc2cc(c(=O)[nH]c2c1C)CN(C3CCCC3)C(=S)Nc4ccc(cc4)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H29N3O2S
All Atoms:31
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:12.6811
Area:639.275
Solvation:-3.30072
Coulombic:-49.4555
Bond Count [?]
All:34
Single:25
Double:9
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:435.583
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.94
LogP (Chemaxon):5.86

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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