Chemical ID: 6195607

CCOC(=O)CSc1nc2cc(ccc2c(=O)n1c3ccc(c(c3)Cl)F)C(=O)OC
Chemical ID:
6195607
Name [?]:
methyl 3-(3-chloro-4-fluoro-phenyl)-2-(ethoxycarbonylmethylsulfanyl)-4-oxo-quinazoline-7-carboxylate
SMILES [?]:
CCOC(=O)CSc1nc2cc(ccc2c(=O)n1c3ccc(c(c3)Cl)F)C(=O)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H16ClFN2O5S
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:11.8349
Area:661.57
Solvation:-4.70431
Coulombic:-64.3454
Bond Count [?]
All:32
Single:22
Double:10
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:450.869
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:3.74
LogP (Chemaxon):3.66

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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