Chemical ID: 5976330

CC(c1ccccc1)NC(=O)c2cc(ccc2N(C)C)NC(=O)c3cc(cc(c3)Cl)Cl
Chemical ID:
5976330
Name [?]:
5-(3,5-dichlorobenzoyl)amino-2-dimethylamino-N-(1-phenylethyl)benzamide
SMILES [?]:
CC(c1ccccc1)NC(=O)c2cc(ccc2N(C)C)NC(=O)c3cc(cc(c3)Cl)Cl
InChi [?]:
InChI=1/C24H23Cl2N3O2/c1-15(16-7-5-4-6-8-16)27-24(31)21-14-20(9-10-22(21)29(2)3)28-23(30)17-11-18(25)13-19(26)12-17/h4-15H,1-3H3,(H,27,31)(H,28,30)
InChi Info:
AuxInfo=1/1/N:1,19,20,6,5,7,4,8,15,16,25,29,27,13,2,3,24,26,28,14,12,17,22,10,31,30,9,21,18,23,11/E:(2,3)(5,6)(7,8)(11,12)(18,19)(25,26)/rA:31cCCCCCCCCNCOCCCCCCNCCNCOCCCCCCClCl/rB:s1;s2;s3;d4;s5;d6;d3s7;s2;s9;d10;s10;s12;d13;s14;d15;d12s16;s17;s18;s18;s14;s21;d22;s22;s24;d25;s26;d27;d24s28;s28;s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H23Cl2N3O2
All Atoms:31
Heavy Atoms:31
Chiral Atoms:1
ZAP Information [?]
Total:13.3908
Area:704.158
Solvation:-4.21315
Coulombic:-50.5311
Bond Count [?]
All:33
Single:22
Double:11
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:456.364
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:6.09
LogP (Chemaxon):5.49

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Descriptor Annotations

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