Chemical ID: 4334827

CC1=C(C(NC(=S)N1C)c2cccc(c2)OC)C(=O)OC
Chemical ID:
4334827
Name [?]:
methyl 4-(3-methoxyphenyl)-1,6-dimethyl-2-thioxo-3,4-dihydropyrimidine-5-carboxylate
SMILES [?]:
CC1=C(C(NC(=S)N1C)c2cccc(c2)OC)C(=O)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C15H18N2O3S
All Atoms:21
Heavy Atoms:21
Chiral Atoms:1
ZAP Information [?]
Total:8.78398
Area:475.011
Solvation:-3.09129
Coulombic:-46.3502
Bond Count [?]
All:22
Single:16
Double:6
Rotors:4
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:306.381
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.29
LogP (Chemaxon):0.95

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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