Chemical ID: 5629587

c1ccc2c(c1)cc(c(=Nc3ccccc3C(=O)N)o2)C(=O)N
Chemical ID:
5629587
Name [?]:
2-(2-carbamoylphenyl)iminochromene-3-carboxamide
SMILES [?]:
c1ccc2c(c1)cc(c(=Nc3ccccc3C(=O)N)o2)C(=O)N
InChi [?]:
InChI=1/C17H13N3O3/c18-15(21)11-6-2-3-7-13(11)20-17-12(16(19)22)9-10-5-1-4-8-14(10)23-17/h1-9H,(H2,18,21)(H2,19,22)
InChi Info:
AuxInfo=1/1/N:1,14,13,2,6,15,12,3,7,5,16,8,11,4,17,21,9,19,23,10,18,22,20/rA:23nCCCCCCCCCNCCCCCCCONOCON/rB:s1;d2;s3;d4;d1s5;s5;d7;s8;w9;s10;s11;d12;s13;d14;d11s15;s16;d17;s17;s4s9;s8;d21;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H13N3O3
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:7.14685
Area:447.892
Solvation:-4.05044
Coulombic:-66.0108
Bond Count [?]
All:25
Single:15
Double:10
Rotors:3
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:307.304
H-Bond Donors:4
H-Bond Acceptors:5
XLogP:1.12
LogP (Chemaxon):1.94

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