Chemical ID: 7490468

CC(C(=O)Nc1ccccc1C(=O)NCCc2ccccc2)Oc3ccc(cc3)Cl
Chemical ID:
7490468
Name [?]:
2-[2-(4-chlorophenoxy)propanoylamino]-N-phenethyl-benzamide
SMILES [?]:
CC(C(=O)Nc1ccccc1C(=O)NCCc2ccccc2)Oc3ccc(cc3)Cl
InChi [?]:
InChI=1/C24H23ClN2O3/c1-17(30-20-13-11-19(25)12-14-20)23(28)27-22-10-6-5-9-21(22)24(29)26-16-15-18-7-3-2-4-8-18/h2-14,17H,15-16H2,1H3,(H,26,29)(H,27,28)
InChi Info:
AuxInfo=1/1/N:1,20,19,21,9,8,18,22,10,7,26,28,25,29,16,15,2,17,27,24,11,6,3,12,30,14,5,4,13,23/E:(3,4)(7,8)(11,12)(13,14)/rA:30cCCCONCCCCCCCONCCCCCCCCOCCCCCCCl/rB:s1;s2;d3;s3;s5;s6;d7;s8;d9;d6s10;s11;d12;s12;s14;s15;s16;s17;d18;s19;d20;d17s21;s2;s23;s24;d25;s26;d27;d24s28;s27;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H23ClN2O3
All Atoms:53
Heavy Atoms:30
Chiral Atoms:1
ZAP Information [?]
Total:12.8269
Area:683.742
Solvation:-4.26669
Coulombic:-54.103
Bond Count [?]
All:32
Single:21
Double:11
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:422.904
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:5.52
LogP (Chemaxon):5.51

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Descriptor Annotations

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