Chemical ID: 4782783

Cc1c(cc(n1c2ccccc2)c3ccccc3)C(=O)Nc4cccc(c4)OC
Chemical ID:
4782783
Name [?]:
N-(3-methoxyphenyl)-2-methyl-1,5-diphenyl-pyrrole-3-carboxamide
SMILES [?]:
Cc1c(cc(n1c2ccccc2)c3ccccc3)C(=O)Nc4cccc(c4)OC
InChi [?]:
InChI=1/C25H22N2O2/c1-18-23(25(28)26-20-12-9-15-22(16-20)29-2)17-24(19-10-5-3-6-11-19)27(18)21-13-7-4-8-14-21/h3-17H,1-2H3,(H,26,28)
InChi Info:
AuxInfo=1/1/N:1,29,16,10,15,17,9,11,24,14,18,23,8,12,25,27,4,2,13,22,7,26,3,5,19,21,6,20,28/E:(5,6)(7,8)(10,11)(13,14)/rA:29nCCCCCNCCCCCCCCCCCCCONCCCCCCOC/rB:s1;d2;s3;d4;s2s5;s6;s7;d8;s9;d10;d7s11;s5;s13;d14;s15;d16;d13s17;s3;d19;s19;s21;s22;d23;s24;d25;d22s26;s26;s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C25H22N2O2
All Atoms:29
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:11.2291
Area:601.656
Solvation:-3.81229
Coulombic:-36.8175
Bond Count [?]
All:32
Single:20
Double:12
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:382.454
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.68
LogP (Chemaxon):4.98

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Descriptor Annotations

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