7-phenyl-[1]benzothiolo[3,2-b]furan-2-carboxamide

C17H11NO2S — CID 143207885

IUPAC7-phenyl-[1]benzothiolo[3,2-b]furan-2-carboxamide
SMILESNC(=O)c1cc2sc3ccc(-c4ccccc4)cc3c2o1
InChIInChI=1S/C17H11NO2S/c18-17(19)13-9-15-16(20-13)12-8-11(6-7-14(12)21-15)10-4-2-1-3-5-10/h1-9H,(H2,18,19)
InChIKeyBFXBGPJAMSRLGS-UHFFFAOYSA-N
MW293.35 g/mol
LogP4.41
Rot. Bonds2

About 7-phenyl-[1]benzothiolo[3,2-b]furan-2-carboxamide

7-phenyl-[1]benzothiolo[3,2-b]furan-2-carboxamide (PubChem CID 143207885) has the molecular formula C17H11NO2S and a molecular weight of 293.35 g/mol. Its IUPAC name is 7-phenyl-[1]benzothiolo[3,2-b]furan-2-carboxamide.

Molecular Properties

Compound Name7-phenyl-[1]benzothiolo[3,2-b]furan-2-carboxamide
PubChem CID143207885
Molecular FormulaC17H11NO2S
Molecular Weight293.35 g/mol
Exact Mass293.05
IUPAC Name7-phenyl-[1]benzothiolo[3,2-b]furan-2-carboxamide
SMILESNC(=O)c1cc2sc3ccc(-c4ccccc4)cc3c2o1
InChIInChI=1S/C17H11NO2S/c18-17(19)13-9-15-16(20-13)12-8-11(6-7-14(12)21-15)10-4-2-1-3-5-10/h1-9H,(H2,18,19)
InChIKeyBFXBGPJAMSRLGS-UHFFFAOYSA-N
XLogP4.41
TPSA56.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.35
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 123879199
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2-bromo-7-phenylthioxanthen-9-one
CID 123137766
2,8-bis(3-naphthalen-2-yl-5-phenylphenyl)dibenzothiophene
CID 58971382
2,8-bis(2-phenylphenyl)dibenzothiophene
CID 58971386
2-(4-iodophenyl)dibenzothiophene
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2-(4-dibenzothiophen-2-ylphenyl)-4,6-diphenylpyrimidine
CID 130210857
N,N-bis(4-dibenzothiophen-2-ylphenyl)-4-(4-phenylphenyl)aniline
CID 90350992
N,4-diphenyl-N-[4-[3-(8-phenyldibenzothiophen-2-yl)phenyl]phenyl]aniline
CID 121296540
6-dibenzothiophen-2-yl-2-[3-(4-phenylphenyl)phenyl]dibenzofuran
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CID 70332064
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CID 145447302

Frequently Asked Questions

What is the IUPAC name of 7-phenyl-[1]benzothiolo[3,2-b]furan-2-carboxamide?
The IUPAC name of 7-phenyl-[1]benzothiolo[3,2-b]furan-2-carboxamide (CID 143207885) is 7-phenyl-[1]benzothiolo[3,2-b]furan-2-carboxamide.
What is the SMILES notation for 7-phenyl-[1]benzothiolo[3,2-b]furan-2-carboxamide?
The canonical SMILES for 7-phenyl-[1]benzothiolo[3,2-b]furan-2-carboxamide is NC(=O)c1cc2sc3ccc(-c4ccccc4)cc3c2o1.
What is the InChIKey of 7-phenyl-[1]benzothiolo[3,2-b]furan-2-carboxamide?
The InChIKey is BFXBGPJAMSRLGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11NO2S/c18-17(19)13-9-15-16(20-13)12-8-11(6-7-14(12)21-15)10-4-2-1-3-5-10/h1-9H,(H2,18,19).
What are the key properties of 7-phenyl-[1]benzothiolo[3,2-b]furan-2-carboxamide?
7-phenyl-[1]benzothiolo[3,2-b]furan-2-carboxamide has a molecular weight of 293.35 g/mol, XLogP of 4.41, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenyl-[1]benzothiolo[3,2-b]furan-2-carboxamide is sourced from PubChem (CID 143207885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).