Chemical ID: 4771300

c1cc(cnc1)CN(Cc2ccc(cc2)Cl)C(=O)c3ccc(cc3)Cl
Chemical ID:
4771300
Name [?]:
4-chloro-N-[(4-chlorophenyl)methyl]-N-(3-pyridylmethyl)benzamide
SMILES [?]:
c1cc(cnc1)CN(Cc2ccc(cc2)Cl)C(=O)c3ccc(cc3)Cl
InChi [?]:
InChI=1/C20H16Cl2N2O/c21-18-7-3-15(4-8-18)13-24(14-16-2-1-11-23-12-16)20(25)17-5-9-19(22)10-6-17/h1-12H,13-14H2
InChi Info:
AuxInfo=1/0/N:1,2,11,15,20,24,12,14,21,23,6,4,9,7,10,3,19,13,22,17,16,25,5,8,18/E:(3,4)(5,6)(7,8)(9,10)/rA:25nCCCCNCCNCCCCCCCClCOCCCCCCCl/rB:s1;d2;s3;d4;d1s5;s3;s7;s8;s9;s10;d11;s12;d13;d10s14;s13;s8;d17;s17;s19;d20;s21;d22;d19s23;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H16Cl2N2O
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:11.4417
Area:570.458
Solvation:-2.81974
Coulombic:-25.286
Bond Count [?]
All:27
Single:17
Double:10
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:371.259
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:4.98
LogP (Chemaxon):4.47

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