Chemical ID: 6758895

c1ccc(cc1)c2c3cccc(c3[nH]c2c4ccccc4)C(=O)[O-]
Chemical ID:
6758895
Name [?]:
2,3-diphenyl-1H-indole-7-carboxylate
SMILES [?]:
c1ccc(cc1)c2c3cccc(c3[nH]c2c4ccccc4)C(=O)[O-]
InChi [?]:
InChI=1/C21H15NO2/c23-21(24)17-13-7-12-16-18(14-8-3-1-4-9-14)19(22-20(16)17)15-10-5-2-6-11-15/h1-13,22H,(H,23,24)/p-1
InChi Info:
AuxInfo=1/1/N:1,19,2,6,18,20,10,3,5,17,21,9,11,4,16,8,12,7,15,13,22,14,23,24/E:(3,4)(5,6)(8,9)(10,11)(23,24)/rA:24nCCCCCCCCCCCCCNCCCCCCCCOO-/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s10;d11;d8s12;s13;d7s14;s15;s16;d17;s18;d19;d16s20;s12;d22;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H14NO2-
All Atoms:38
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:-30.8918
Area:503.91
Solvation:-43.4895
Coulombic:-15.3392
Bond Count [?]
All:27
Single:16
Double:11
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:312.341
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:5.12
LogP (Chemaxon):5.1

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Descriptor Annotations

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