Chemical ID: 6652099

c1cc(cc(c1)Cl)C(=O)NCC(=O)NN=Cc2ccc(cc2Cl)Cl
Chemical ID:
6652099
Name [?]:
3-chloro-N-[(2,4-dichlorophenyl)methyleneaminocarbamoylmethyl]benzamide
SMILES [?]:
c1cc(cc(c1)Cl)C(=O)NCC(=O)NN=Cc2ccc(cc2Cl)Cl
InChi [?]:
InChI=1/C16H12Cl3N3O2/c17-12-3-1-2-10(6-12)16(24)20-9-15(23)22-21-8-11-4-5-13(18)7-14(11)19/h1-8H,9H2,(H,20,24)(H,22,23)
InChi Info:
AuxInfo=1/1/N:1,2,6,18,19,4,21,16,11,3,17,5,20,22,12,8,7,24,23,10,15,14,13,9/rA:24nCCCCCCClCONCCONNCCCCCCCClCl/rB:s1;d2;s3;d4;d1s5;s5;s3;d8;s8;s10;s11;d12;s12;s14;w15;s16;s17;d18;s19;d20;d17s21;s22;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H12Cl3N3O2
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:11.2208
Area:604.434
Solvation:-3.89007
Coulombic:-42.1379
Bond Count [?]
All:25
Single:16
Double:9
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:384.644
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:5.03
LogP (Chemaxon):3.72

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