Chemical ID: 5932800

CN(Cc1ccccc1)Cc2ccc(o2)C(=O)NC(c3ccccc3)c4ccccc4
Chemical ID:
5932800
Name [?]:
N-benzhydryl-5-[(benzyl-methyl-amino)methyl]furan-2-carboxamide
SMILES [?]:
CN(Cc1ccccc1)Cc2ccc(o2)C(=O)NC(c3ccccc3)c4ccccc4
InChi [?]:
InChI=1/C27H26N2O2/c1-29(19-21-11-5-2-6-12-21)20-24-17-18-25(31-24)27(30)28-26(22-13-7-3-8-14-22)23-15-9-4-10-16-23/h2-18,26H,19-20H2,1H3,(H,28,30)
InChi Info:
AuxInfo=1/1/N:1,7,23,29,6,8,22,24,28,30,5,9,21,25,27,31,12,13,3,10,4,20,26,11,14,19,16,18,2,17,15/E:(3,4)(5,6)(7,8,9,10)(11,12)(13,14,15,16)(22,23)/rA:31cCNCCCCCCCCCCCCOCONCCCCCCCCCCCCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s2;s10;d11;s12;d13;s11s14;s14;d16;s16;s18;s19;s20;d21;s22;d23;d20s24;s19;s26;d27;s28;d29;d26s30;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C27H26N2O2
All Atoms:31
Heavy Atoms:31
Chiral Atoms:1
ZAP Information [?]
Total:13.1999
Area:677.645
Solvation:-3.74126
Coulombic:-40.6912
Bond Count [?]
All:34
Single:22
Double:12
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:410.508
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.88
LogP (Chemaxon):4.94

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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