Chemical ID: 6461079

c1ccc(c(c1)NC(=O)c2ccc(c(c2)Cl)Cl)N3CCOCC3
Chemical ID:
6461079
Name [?]:
3,4-dichloro-N-(2-morpholinophenyl)-benzamide
SMILES [?]:
c1ccc(c(c1)NC(=O)c2ccc(c(c2)Cl)Cl)N3CCOCC3
InChi [?]:
InChI=1/C17H16Cl2N2O2/c18-13-6-5-12(11-14(13)19)17(22)20-15-3-1-2-4-16(15)21-7-9-23-10-8-21/h1-6,11H,7-10H2,(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,11,12,19,23,20,22,15,10,13,14,5,4,8,17,16,7,18,9,21/E:(7,8)(9,10)/rA:23nCCCCCCNCOCCCCCCClClNCCOCC/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s8;s10;d11;s12;d13;d10s14;s14;s13;s4;s18;s19;s20;s21;s18s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H16Cl2N2O2
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:10.0528
Area:538.964
Solvation:-3.4213
Coulombic:-38.0028
Bond Count [?]
All:25
Single:18
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:351.227
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.05
LogP (Chemaxon):4.06

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