N-(3-bromo-4-fluorophenyl)-2-chloro-5-[(3-hydroxycyclohexyl)sulfamoyl]benzamide;N-(3-bromo-4-fluorophenyl)-4-chloro-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(2-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide

C76H76Br2Cl6F4N8O16S4 — CID 159647372

IUPACN-(3-bromo-4-fluorophenyl)-2-chloro-5-[(3-hydroxycyclohexyl)sulfamoyl]benzamide;N-(3-bromo-4-fluorophenyl)-4-chloro-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(2-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide
SMILESO=C(Nc1ccc(F)c(Br)c1)c1cc(S(=O)(=O)NC2CCCC(O)C2)ccc1Cl.O=C(Nc1ccc(F)c(Br)c1)c1ccc(Cl)c(S(=O)(=O)NC2CCC(O)CC2)c1.O=C(Nc1ccc(F)c(Cl)c1)c1ccc(Cl)c(S(=O)(=O)NC2CCC(O)CC2)c1.O=C(Nc1ccc(F)c(Cl)c1)c1ccc(Cl)c(S(=O)(=O)NC2CCCCC2O)c1
InChIInChI=1S/2C19H19BrClFN2O4S.2C19H19Cl2FN2O4S/c20-15-10-13(4-8-17(15)22)23-19(26)11-1-7-16(21)18(9-11)29(27,28)24-12-2-5-14(25)6-3-12;20-16-9-11(4-7-18(16)22)23-19(26)15-10-14(5-6-17(15)21)29(27,28)24-12-2-1-3-13(25)8-12;20-15-7-1-11(19(26)23-13-4-8-17(22)16(21)10-13)9-18(15)29(27,28)24-12-2-5-14(25)6-3-12;20-13-7-5-11(19(26)23-12-6-8-15(22)14(21)10-12)9-18(13)29(27,28)24-16-3-1-2-4-17(16)25/h1,4,7-10,12,14,24-25H,2-3,5-6H2,(H,23,26);4-7,9-10,12-13,24-25H,1-3,8H2,(H,23,26);1,4,7-10,12,14,24-25H,2-3,5-6H2,(H,23,26);5-10,16-17,24-25H,1-4H2,(H,23,26)
InChIKeyMRCXMQMTJXKQJE-UHFFFAOYSA-N
MW1934.27 g/mol
LogP16.08
Rot. Bonds20

About N-(3-bromo-4-fluorophenyl)-2-chloro-5-[(3-hydroxycyclohexyl)sulfamoyl]benzamide;N-(3-bromo-4-fluorophenyl)-4-chloro-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(2-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide

N-(3-bromo-4-fluorophenyl)-2-chloro-5-[(3-hydroxycyclohexyl)sulfamoyl]benzamide;N-(3-bromo-4-fluorophenyl)-4-chloro-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(2-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide (PubChem CID 159647372) has the molecular formula C76H76Br2Cl6F4N8O16S4 and a molecular weight of 1934.27 g/mol. Its IUPAC name is N-(3-bromo-4-fluorophenyl)-2-chloro-5-[(3-hydroxycyclohexyl)sulfamoyl]benzamide;N-(3-bromo-4-fluorophenyl)-4-chloro-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(2-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-(3-bromo-4-fluorophenyl)-2-chloro-5-[(3-hydroxycyclohexyl)sulfamoyl]benzamide;N-(3-bromo-4-fluorophenyl)-4-chloro-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(2-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide
PubChem CID159647372
Molecular FormulaC76H76Br2Cl6F4N8O16S4
Molecular Weight1934.27 g/mol
Exact Mass1928.07
IUPAC NameN-(3-bromo-4-fluorophenyl)-2-chloro-5-[(3-hydroxycyclohexyl)sulfamoyl]benzamide;N-(3-bromo-4-fluorophenyl)-4-chloro-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(2-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide
SMILESO=C(Nc1ccc(F)c(Br)c1)c1cc(S(=O)(=O)NC2CCCC(O)C2)ccc1Cl.O=C(Nc1ccc(F)c(Br)c1)c1ccc(Cl)c(S(=O)(=O)NC2CCC(O)CC2)c1.O=C(Nc1ccc(F)c(Cl)c1)c1ccc(Cl)c(S(=O)(=O)NC2CCC(O)CC2)c1.O=C(Nc1ccc(F)c(Cl)c1)c1ccc(Cl)c(S(=O)(=O)NC2CCCCC2O)c1
InChIInChI=1S/2C19H19BrClFN2O4S.2C19H19Cl2FN2O4S/c20-15-10-13(4-8-17(15)22)23-19(26)11-1-7-16(21)18(9-11)29(27,28)24-12-2-5-14(25)6-3-12;20-16-9-11(4-7-18(16)22)23-19(26)15-10-14(5-6-17(15)21)29(27,28)24-12-2-1-3-13(25)8-12;20-15-7-1-11(19(26)23-13-4-8-17(22)16(21)10-13)9-18(15)29(27,28)24-12-2-5-14(25)6-3-12;20-13-7-5-11(19(26)23-12-6-8-15(22)14(21)10-12)9-18(13)29(27,28)24-16-3-1-2-4-17(16)25/h1,4,7-10,12,14,24-25H,2-3,5-6H2,(H,23,26);4-7,9-10,12-13,24-25H,1-3,8H2,(H,23,26);1,4,7-10,12,14,24-25H,2-3,5-6H2,(H,23,26);5-10,16-17,24-25H,1-4H2,(H,23,26)
InChIKeyMRCXMQMTJXKQJE-UHFFFAOYSA-N
XLogP16.08
TPSA382.00 Ų
H-Bond Donors12
H-Bond Acceptors16
Rotatable Bonds20
Heavy Atoms116
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001934.27
LogP ≤ 516.08
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1016

Analyze N-(3-bromo-4-fluorophenyl)-2-chloro-5-[(3-hydroxycyclohexyl)sulfamoyl]benzamide;N-(3-bromo-4-fluorophenyl)-4-chloro-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(2-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide with MolForge

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Related Compounds

N-(3-bromo-4-fluorophenyl)-3-[(3-hydroxycyclohexyl)sulfamoyl]benzamide;N-(3-chloro-4-fluorophenyl)-4-fluoro-3-[(2-hydroxycyclohexyl)sulfamoyl]benzamide;N-[3,4-difluoro-5-(fluoromethyl)phenyl]-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide;4-fluoro-3-[(3-hydroxycyclohexyl)sulfamoyl]-N-(3,4,5-trifluorophenyl)benzamide
CID 158663938
N-(3-bromo-4-fluorophenyl)-2-chloro-5-[(2-methoxycyclopentyl)sulfamoyl]benzamide
CID 130254615
3-chloro-4-fluoro-N-[(1R,3R)-3-hydroxycyclohexyl]benzenesulfonamide
CID 95984027
N-(3-chloro-4-fluorophenyl)-3-(cyclopentylsulfamoyl)-4-methoxybenzamide
CID 41451558
5-(cyclopentylsulfamoyl)-N-(3,5-dichlorophenyl)-2-fluorobenzamide
CID 4190475
N-(4-fluoro-3-methylphenyl)-3-[[(1R,3S)-3-hydroxycyclopentyl]sulfamoyl]benzamide
CID 118380733
5-(cyclohexylsulfamoyl)-N-(3,5-dichlorophenyl)-2-fluorobenzamide
CID 4190474
5-chloro-N-[4-(cyclopentylsulfamoyl)phenyl]-2-fluorobenzamide
CID 119045142
N-(3-chlorophenyl)-5-(cyclohexylsulfamoyl)-2-fluorobenzamide
CID 90075218
N-(4-fluoro-3-methylphenyl)-3-[[(1S,2S)-2-hydroxycyclohexyl]sulfamoyl]benzamide
CID 90075233
3-bromo-4-chloro-N-(2-hydroxycyclohexyl)benzenesulfonamide
CID 106546192
4-chloro-N-[4-(cyclopentylsulfamoyl)-2-fluorophenyl]benzamide
CID 18892580

Frequently Asked Questions

What is the IUPAC name of N-(3-bromo-4-fluorophenyl)-2-chloro-5-[(3-hydroxycyclohexyl)sulfamoyl]benzamide;N-(3-bromo-4-fluorophenyl)-4-chloro-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(2-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide?
The IUPAC name of N-(3-bromo-4-fluorophenyl)-2-chloro-5-[(3-hydroxycyclohexyl)sulfamoyl]benzamide;N-(3-bromo-4-fluorophenyl)-4-chloro-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(2-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide (CID 159647372) is N-(3-bromo-4-fluorophenyl)-2-chloro-5-[(3-hydroxycyclohexyl)sulfamoyl]benzamide;N-(3-bromo-4-fluorophenyl)-4-chloro-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(2-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide.
What is the SMILES notation for N-(3-bromo-4-fluorophenyl)-2-chloro-5-[(3-hydroxycyclohexyl)sulfamoyl]benzamide;N-(3-bromo-4-fluorophenyl)-4-chloro-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(2-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide?
The canonical SMILES for N-(3-bromo-4-fluorophenyl)-2-chloro-5-[(3-hydroxycyclohexyl)sulfamoyl]benzamide;N-(3-bromo-4-fluorophenyl)-4-chloro-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(2-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide is O=C(Nc1ccc(F)c(Br)c1)c1cc(S(=O)(=O)NC2CCCC(O)C2)ccc1Cl.O=C(Nc1ccc(F)c(Br)c1)c1ccc(Cl)c(S(=O)(=O)NC2CCC(O)CC2)c1.O=C(Nc1ccc(F)c(Cl)c1)c1ccc(Cl)c(S(=O)(=O)NC2CCC(O)CC2)c1.O=C(Nc1ccc(F)c(Cl)c1)c1ccc(Cl)c(S(=O)(=O)NC2CCCCC2O)c1.
What is the InChIKey of N-(3-bromo-4-fluorophenyl)-2-chloro-5-[(3-hydroxycyclohexyl)sulfamoyl]benzamide;N-(3-bromo-4-fluorophenyl)-4-chloro-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(2-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide?
The InChIKey is MRCXMQMTJXKQJE-UHFFFAOYSA-N. The full InChI is InChI=1S/2C19H19BrClFN2O4S.2C19H19Cl2FN2O4S/c20-15-10-13(4-8-17(15)22)23-19(26)11-1-7-16(21)18(9-11)29(27,28)24-12-2-5-14(25)6-3-12;20-16-9-11(4-7-18(16)22)23-19(26)15-10-14(5-6-17(15)21)29(27,28)24-12-2-1-3-13(25)8-12;20-15-7-1-11(19(26)23-13-4-8-17(22)16(21)10-13)9-18(15)29(27,28)24-12-2-5-14(25)6-3-12;20-13-7-5-11(19(26)23-12-6-8-15(22)14(21)10-12)9-18(13)29(27,28)24-16-3-1-2-4-17(16)25/h1,4,7-10,12,14,24-25H,2-3,5-6H2,(H,23,26);4-7,9-10,12-13,24-25H,1-3,8H2,(H,23,26);1,4,7-10,12,14,24-25H,2-3,5-6H2,(H,23,26);5-10,16-17,24-25H,1-4H2,(H,23,26).
What are the key properties of N-(3-bromo-4-fluorophenyl)-2-chloro-5-[(3-hydroxycyclohexyl)sulfamoyl]benzamide;N-(3-bromo-4-fluorophenyl)-4-chloro-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(2-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide?
N-(3-bromo-4-fluorophenyl)-2-chloro-5-[(3-hydroxycyclohexyl)sulfamoyl]benzamide;N-(3-bromo-4-fluorophenyl)-4-chloro-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(2-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide has a molecular weight of 1934.27 g/mol, XLogP of 16.08, 20 rotatable bonds, 12 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromo-4-fluorophenyl)-2-chloro-5-[(3-hydroxycyclohexyl)sulfamoyl]benzamide;N-(3-bromo-4-fluorophenyl)-4-chloro-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(2-hydroxycyclohexyl)sulfamoyl]benzamide;4-chloro-N-(3-chloro-4-fluorophenyl)-3-[(4-hydroxycyclohexyl)sulfamoyl]benzamide is sourced from PubChem (CID 159647372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).