Chemical ID: 6646530

Cc1c(cccc1Cl)NC(=O)C(=O)NN=Cc2ccc(cc2)N(C)C
Chemical ID:
6646530
Name [?]:
N-(3-chloro-2-methyl-phenyl)-N'-[(4-dimethylaminophenyl)methyleneamino]oxamide
SMILES [?]:
Cc1c(cccc1Cl)NC(=O)C(=O)NN=Cc2ccc(cc2)N(C)C
InChi [?]:
InChI=1/C18H19ClN4O2/c1-12-15(19)5-4-6-16(12)21-17(24)18(25)22-20-11-13-7-9-14(10-8-13)23(2)3/h4-11H,1-3H3,(H,21,24)(H,22,25)
InChi Info:
AuxInfo=1/1/N:1,24,25,5,6,4,18,22,19,21,16,2,17,20,7,3,10,12,8,15,9,14,23,11,13/E:(2,3)(7,8)(9,10)/rA:25nCCCCCCCClNCOCONNCCCCCCCNCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s3;s9;d10;s10;d12;s12;s14;w15;s16;s17;d18;s19;d20;d17s21;s20;s23;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H19ClN4O2
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:11.401
Area:579.258
Solvation:-3.08049
Coulombic:-51.1988
Bond Count [?]
All:26
Single:17
Double:9
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:358.822
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:4.08
LogP (Chemaxon):3.58

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