Chemical ID: 4973526

c1cc(c(cc1c2c(c3cc(ccc3[nH]2)F)C=O)Cl)Cl
Chemical ID:
4973526
Name [?]:
2-(3,4-dichlorophenyl)-5-fluoro-1H-indole-3-carbaldehyde
SMILES [?]:
c1cc(c(cc1c2c(c3cc(ccc3[nH]2)F)C=O)Cl)Cl
InChi [?]:
InChI=1/C15H8Cl2FNO/c16-12-3-1-8(5-13(12)17)15-11(7-20)10-6-9(18)2-4-14(10)19-15/h1-7,19H
InChi Info:
AuxInfo=1/0/N:1,12,2,13,5,10,17,6,11,9,8,3,4,14,7,20,19,16,15,18/rA:20nCCCCCCCCCCCCCCNFCOClCl/rB:s1;d2;s3;d4;d1s5;s6;d7;s8;s9;d10;s11;d12;d9s13;s7s14;s11;s8;d17;s4;s3;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H8Cl2FNO
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.43562
Area:468.378
Solvation:-3.27384
Coulombic:-23.2066
Bond Count [?]
All:22
Single:14
Double:8
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:308.134
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:5.15
LogP (Chemaxon):4.75

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Descriptor Annotations

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