Chemical ID: 4143557

CCc1ccccc1NC(=O)C(C)N2C(=O)c3ccccc3C2=O
Chemical ID:
4143557
Name [?]:
2-(1,3-dioxoisoindolin-2-yl)-N-(2-ethylphenyl)-propanamide
SMILES [?]:
CCc1ccccc1NC(=O)C(C)N2C(=O)c3ccccc3C2=O
InChi [?]:
InChI=1/C19H18N2O3/c1-3-13-8-4-7-11-16(13)20-17(22)12(2)21-18(23)14-9-5-6-10-15(14)19(21)24/h4-12H,3H2,1-2H3,(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,13,2,5,19,20,6,4,18,21,7,12,3,17,22,8,10,15,23,9,14,11,16,24/E:(5,6)(9,10)(14,15)(18,19)(23,24)/rA:24cCCCCCCCCNCOCCNCOCCCCCCCO/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s12;s12;s14;d15;s15;s17;d18;s19;d20;d17s21;s14s22;d23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H18N2O3
All Atoms:24
Heavy Atoms:24
Chiral Atoms:1
ZAP Information [?]
Total:9.63194
Area:519.382
Solvation:-3.35261
Coulombic:-48.3377
Bond Count [?]
All:26
Single:17
Double:9
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:322.358
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.09
LogP (Chemaxon):2.46

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