Chemical ID: 7038772

COc1cccc(c1)C(NC(=O)Cc2ccccc2)NC(=O)Cc3ccccc3
Chemical ID:
7038772
Name [?]:
N-[(3-methoxyphenyl)-(2-phenylacetyl)amino-methyl]-2-phenyl-acetamide
SMILES [?]:
COc1cccc(c1)C(NC(=O)Cc2ccccc2)NC(=O)Cc3ccccc3
InChi [?]:
InChI=1/C24H24N2O3/c1-29-21-14-8-13-20(17-21)24(25-22(27)15-18-9-4-2-5-10-18)26-23(28)16-19-11-6-3-7-12-19/h2-14,17,24H,15-16H2,1H3,(H,25,27)(H,26,28)
InChi Info:
AuxInfo=1/1/N:1,17,27,16,18,26,28,5,15,19,25,29,6,4,13,23,8,14,24,7,3,11,21,9,10,20,12,22,2/E:(2,3)(4,5,6,7)(9,10,11,12)(15,16)(18,19)(22,23)(25,26)(27,28)/gE:(1,2)/rA:29nCOCCCCCCCNCOCCCCCCCNCOCCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s7;s9;s10;d11;s11;s13;s14;d15;s16;d17;d14s18;s9;s20;d21;s21;s23;s24;d25;s26;d27;d24s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C24H24N2O3
All Atoms:53
Heavy Atoms:29
Chiral Atoms:0
ZAP Information [?]
Total:9.9793
Area:641.314
Solvation:-6.05355
Coulombic:-49.8488
Bond Count [?]
All:31
Single:20
Double:11
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:388.459
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:4.13
LogP (Chemaxon):3.8

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Descriptor Annotations

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