Chemical ID: 5993246

CC1=C(C(NC(=S)N1C)c2ccc(cc2)NC(=O)C)C(=O)OC(C)C
Chemical ID:
5993246
Name [?]:
isopropyl 4-(4-acetamidophenyl)-1,6-dimethyl-2-thioxo-3,4-dihydropyrimidine-5-carboxylate
SMILES [?]:
CC1=C(C(NC(=S)N1C)c2ccc(cc2)NC(=O)C)C(=O)OC(C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H23N3O3S
All Atoms:25
Heavy Atoms:25
Chiral Atoms:1
ZAP Information [?]
Total:10.8529
Area:552.286
Solvation:-2.95429
Coulombic:-58.2401
Bond Count [?]
All:26
Single:19
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:361.46
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:2.51
LogP (Chemaxon):1.28

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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