Chemical ID: 4325679

CC1=C(C(C(=C(N1)C)C(=O)OC)c2c(cccc2Cl)F)C(=O)OC
Chemical ID:
4325679
Name [?]:
dimethyl 4-(2-chloro-6-fluoro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate
SMILES [?]:
CC1=C(C(C(=C(N1)C)C(=O)OC)c2c(cccc2Cl)F)C(=O)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H17ClFNO4
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:8.73785
Area:483.046
Solvation:-3.3383
Coulombic:-53.0297
Bond Count [?]
All:25
Single:18
Double:7
Rotors:5
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:353.772
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.26
LogP (Chemaxon):0.95

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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