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

C14H12BrClN2O2S — CID 81281250

IUPACN-(2-bromo-5-chlorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide
SMILESO=S(=O)(Nc1cc(Cl)ccc1Br)c1ccc2c(c1)CCN2
InChIInChI=1S/C14H12BrClN2O2S/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
InChIKeyHFPFJZAZTRDXFZ-UHFFFAOYSA-N
MW387.69 g/mol
LogP3.87
Rot. Bonds3

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

N-(2-bromo-5-chlorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide (PubChem CID 81281250) has the molecular formula C14H12BrClN2O2S and a molecular weight of 387.69 g/mol. Its IUPAC name is N-(2-bromo-5-chlorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide.

Molecular Properties

Compound NameN-(2-bromo-5-chlorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide
PubChem CID81281250
Molecular FormulaC14H12BrClN2O2S
Molecular Weight387.69 g/mol
Exact Mass385.95
IUPAC NameN-(2-bromo-5-chlorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide
SMILESO=S(=O)(Nc1cc(Cl)ccc1Br)c1ccc2c(c1)CCN2
InChIInChI=1S/C14H12BrClN2O2S/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
InChIKeyHFPFJZAZTRDXFZ-UHFFFAOYSA-N
XLogP3.87
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.69
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bromo-5-fluorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 107626863
N-(2-bromo-5-chlorophenyl)-2,3-dihydro-1H-indene-5-sulfonamide
CID 81260770
N-(2-chloro-4-fluorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 29080528
N-(2-chloro-4-iodophenyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 107605731
N-(4-iodophenyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 28976761
4-amino-N-(2-bromo-5-chlorophenyl)benzenesulfonamide
CID 81263027
3-amino-N-(2-bromo-5-chlorophenyl)-4-fluorobenzenesulfonamide
CID 81262729
N-pyrazin-2-yl-2,3-dihydro-1H-indole-5-sulfonamide
CID 43616214
N-(4-methyl-2-pyridinyl)-2,3-dihydro-1H-indole-5-sulfonamide
CID 43119948
4-chloro-N-(2,3-dihydro-1H-indol-5-yl)-2-methylbenzenesulfonamide
CID 43604283
N-(2-bromo-5-chlorophenyl)-1H-pyrazole-4-sulfonamide
CID 81274575
2,4-dibromo-N-(2,3-dihydro-1H-indol-5-yl)benzenesulfonamide
CID 60824049

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-5-chlorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide?
The IUPAC name of N-(2-bromo-5-chlorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide (CID 81281250) is N-(2-bromo-5-chlorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide.
What is the SMILES notation for N-(2-bromo-5-chlorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide?
The canonical SMILES for N-(2-bromo-5-chlorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide is O=S(=O)(Nc1cc(Cl)ccc1Br)c1ccc2c(c1)CCN2.
What is the InChIKey of N-(2-bromo-5-chlorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide?
The InChIKey is HFPFJZAZTRDXFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrClN2O2S/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-chlorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide?
N-(2-bromo-5-chlorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide has a molecular weight of 387.69 g/mol, XLogP of 3.87, 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-chlorophenyl)-2,3-dihydro-1H-indole-5-sulfonamide is sourced from PubChem (CID 81281250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).