Chemical ID: 5591341

CC(=O)Nc1ccc(cc1)NC(=O)CCNC(=O)c2ccccc2Cl
Chemical ID:
5591341
Name [?]:
N-[2-[(4-acetamidophenyl)carbamoyl]ethyl]-2-chloro-benzamide
SMILES [?]:
CC(=O)Nc1ccc(cc1)NC(=O)CCNC(=O)c2ccccc2Cl
InChi [?]:
InChI=1/C18H18ClN3O3/c1-12(23)21-13-6-8-14(9-7-13)22-17(24)10-11-20-18(25)15-4-2-3-5-16(15)19/h2-9H,10-11H2,1H3,(H,20,25)(H,21,23)(H,22,24)
InChi Info:
AuxInfo=1/1/N:1,21,22,20,23,6,10,7,9,14,15,2,5,8,19,24,12,17,25,16,4,11,3,13,18/E:(6,7)(8,9)/rA:25nCCONCCCCCCNCOCCNCOCCCCCCCl/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s8;s11;d12;s12;s14;s15;s16;d17;s17;s19;d20;s21;d22;d19s23;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H18ClN3O3
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:9.64389
Area:588.303
Solvation:-5.06368
Coulombic:-60.0279
Bond Count [?]
All:26
Single:17
Double:9
Rotors:9
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:359.807
H-Bond Donors:3
H-Bond Acceptors:6
XLogP:1.78
LogP (Chemaxon):2.05

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