N-(2-bromo-5-fluorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide

C14H12BrFN2O2S — CID 107626863

IUPACN-(2-bromo-5-fluorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide
SMILESO=S(=O)(Nc1cc(F)ccc1Br)c1ccc2c(c1)CCN2
InChIInChI=1S/C14H12BrFN2O2S/c15-12-3-1-10(16)8-14(12)18-21(19,20)11-2-4-13-9(7-11)5-6-17-13/h1-4,7-8,17-18H,5-6H2
InChIKeyQHDDVYCRCUNBGR-UHFFFAOYSA-N
MW371.23 g/mol
LogP3.36
Rot. Bonds3

About N-(2-bromo-5-fluorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide

N-(2-bromo-5-fluorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide (PubChem CID 107626863) has the molecular formula C14H12BrFN2O2S and a molecular weight of 371.23 g/mol. Its IUPAC name is N-(2-bromo-5-fluorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide.

Molecular Properties

Compound NameN-(2-bromo-5-fluorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide
PubChem CID107626863
Molecular FormulaC14H12BrFN2O2S
Molecular Weight371.23 g/mol
Exact Mass369.98
IUPAC NameN-(2-bromo-5-fluorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide
SMILESO=S(=O)(Nc1cc(F)ccc1Br)c1ccc2c(c1)CCN2
InChIInChI=1S/C14H12BrFN2O2S/c15-12-3-1-10(16)8-14(12)18-21(19,20)11-2-4-13-9(7-11)5-6-17-13/h1-4,7-8,17-18H,5-6H2
InChIKeyQHDDVYCRCUNBGR-UHFFFAOYSA-N
XLogP3.36
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.23
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bromo-5-chlorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 81281250
N-(2-chloro-4-fluorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 29080528
N-(4-iodophenyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 28976761
N-(2-chloro-4-iodophenyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 107605731
N-pyrazin-2-yl-2,3-dihydro-1H-indole-5-sulfonamide
CID 43616214
3-amino-N-(2-bromo-5-fluorophenyl)-4-hydroxybenzenesulfonamide
CID 107624656
N-(4-methyl-2-pyridinyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 43119948
4-acetyl-N-(2-bromo-5-fluorophenyl)benzenesulfonamide
CID 103752842
2,4-dibromo-N-(2,3-dihydro-1H-indol-5-yl)benzenesulfonamide
CID 60824049
4-fluoro-N-(6-methyl-1,2,3,4-tetrahydroquinolin-7-yl)benzenesulfonamide
CID 69083028
N-(2-bromo-5-fluorophenyl)-2,5-difluorobenzenesulfonamide
CID 103752869
N-(2-bromo-5-fluorophenyl)-4-propylbenzenesulfonamide
CID 107640872

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-5-fluorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide?
The IUPAC name of N-(2-bromo-5-fluorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide (CID 107626863) is N-(2-bromo-5-fluorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide.
What is the SMILES notation for N-(2-bromo-5-fluorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide?
The canonical SMILES for N-(2-bromo-5-fluorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide is O=S(=O)(Nc1cc(F)ccc1Br)c1ccc2c(c1)CCN2.
What is the InChIKey of N-(2-bromo-5-fluorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide?
The InChIKey is QHDDVYCRCUNBGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrFN2O2S/c15-12-3-1-10(16)8-14(12)18-21(19,20)11-2-4-13-9(7-11)5-6-17-13/h1-4,7-8,17-18H,5-6H2.
What are the key properties of N-(2-bromo-5-fluorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide?
N-(2-bromo-5-fluorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide has a molecular weight of 371.23 g/mol, XLogP of 3.36, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-5-fluorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide is sourced from PubChem (CID 107626863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).