Chemical ID: 6631370

Cc1c(cccc1Cl)NC(=O)C(=O)NN=Cc2cccc3c2cccc3
Chemical ID:
6631370
Name [?]:
N-(3-chloro-2-methyl-phenyl)-N'-(1-naphthylmethyleneamino)oxamide
SMILES [?]:
Cc1c(cccc1Cl)NC(=O)C(=O)NN=Cc2cccc3c2cccc3
InChi [?]:
InChI=1/C20H16ClN3O2/c1-13-17(21)10-5-11-18(13)23-19(25)20(26)24-22-12-15-8-4-7-14-6-2-3-9-16(14)15/h2-12H,1H3,(H,23,25)(H,24,26)
InChi Info:
AuxInfo=1/1/N:1,25,24,19,5,26,20,18,23,6,4,16,2,21,17,22,7,3,10,12,8,15,9,14,11,13/rA:26nCCCCCCCClNCOCONNCCCCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s3;s9;d10;s10;d12;s12;s14;w15;s16;s17;d18;s19;d20;d17s21;s22;d23;s24;s21d25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H16ClN3O2
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:11.5708
Area:571.301
Solvation:-2.71171
Coulombic:-46.7293
Bond Count [?]
All:28
Single:17
Double:11
Rotors:6
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:365.813
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:5.14
LogP (Chemaxon):4.32

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