Chemical ID: 4947427

Cc1cc2c(=O)cc([nH]c2nc1)c3cccc(c3)Cl
Chemical ID:
4947427
Name [?]:
2-(3-chlorophenyl)-6-methyl-1H-[1,8]naphthyridin-4-one
SMILES [?]:
Cc1cc2c(=O)cc([nH]c2nc1)c3cccc(c3)Cl
InChi [?]:
InChI=1/C15H11ClN2O/c1-9-5-12-14(19)7-13(18-15(12)17-8-9)10-3-2-4-11(16)6-10/h2-8H,1H3,(H,17,18,19)
InChi Info:
AuxInfo=1/1/N:1,15,14,16,3,18,7,12,2,13,17,4,8,5,10,19,11,9,6/rA:19nCCCCCOCCNCNCCCCCCCCl/rB:s1;s2;d3;s4;d5;s5;d7;s8;s4s9;d10;d2s11;s8;s13;d14;s15;d16;d13s17;s17;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H11ClN2O
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:9.1165
Area:450.318
Solvation:-2.14145
Coulombic:-26.0906
Bond Count [?]
All:21
Single:13
Double:8
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:270.713
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:4.07
LogP (Chemaxon):3.55

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Descriptor Annotations

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