Chemical ID: 7283964

CCC(C)c1ccc(cc1)NC(=O)c2cccc(c2)NC(=O)C
Chemical ID:
7283964
Name [?]:
3-acetamido-N-(4-sec-butylphenyl)-benzamide
SMILES [?]:
CCC(C)c1ccc(cc1)NC(=O)c2cccc(c2)NC(=O)C
InChi [?]:
InChI=1/C19H22N2O2/c1-4-13(2)15-8-10-17(11-9-15)21-19(23)16-6-5-7-18(12-16)20-14(3)22/h5-13H,4H2,1-3H3,(H,20,22)(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,4,23,2,16,15,17,6,10,7,9,19,3,21,5,14,8,18,12,20,11,22,13/E:(8,9)(10,11)/rA:23cCCCCCCCCCCNCOCCCCCCNCOC/rB:s1;s2;s3;s3;s5;d6;s7;d8;d5s9;s8;s11;d12;s12;s14;d15;s16;d17;d14s18;s18;s20;d21;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H22N2O2
All Atoms:45
Heavy Atoms:23
Chiral Atoms:1
ZAP Information [?]
Total:10.2681
Area:542.256
Solvation:-3.28829
Coulombic:-41.9743
Bond Count [?]
All:24
Single:16
Double:8
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:310.39
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:4.22
LogP (Chemaxon):4.02

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Descriptor Annotations

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