N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-cyclopropyl-1,3-thiazole-5-carboxamide

C19H16ClN3O3S2 — CID 86891281

IUPACN-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-cyclopropyl-1,3-thiazole-5-carboxamide
SMILESO=C(Nc1cccc(S(=O)(=O)Nc2ccccc2Cl)c1)c1cnc(C2CC2)s1
InChIInChI=1S/C19H16ClN3O3S2/c20-15-6-1-2-7-16(15)23-28(25,26)14-5-3-4-13(10-14)22-18(24)17-11-21-19(27-17)12-8-9-12/h1-7,10-12,23H,8-9H2,(H,22,24)
InChIKeyCZXFVGSVTLUROU-UHFFFAOYSA-N
MW433.94 g/mol
LogP4.73
Rot. Bonds6

About N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-cyclopropyl-1,3-thiazole-5-carboxamide

N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-cyclopropyl-1,3-thiazole-5-carboxamide (PubChem CID 86891281) has the molecular formula C19H16ClN3O3S2 and a molecular weight of 433.94 g/mol. Its IUPAC name is N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-cyclopropyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-cyclopropyl-1,3-thiazole-5-carboxamide
PubChem CID86891281
Molecular FormulaC19H16ClN3O3S2
Molecular Weight433.94 g/mol
Exact Mass433.03
IUPAC NameN-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-cyclopropyl-1,3-thiazole-5-carboxamide
SMILESO=C(Nc1cccc(S(=O)(=O)Nc2ccccc2Cl)c1)c1cnc(C2CC2)s1
InChIInChI=1S/C19H16ClN3O3S2/c20-15-6-1-2-7-16(15)23-28(25,26)14-5-3-4-13(10-14)22-18(24)17-11-21-19(27-17)12-8-9-12/h1-7,10-12,23H,8-9H2,(H,22,24)
InChIKeyCZXFVGSVTLUROU-UHFFFAOYSA-N
XLogP4.73
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.94
LogP ≤ 54.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-5-nitrothiophene-2-carboxamide
CID 26593085
N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]pyridine-3-carboxamide
CID 29373777
2,5-dichloro-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]benzamide
CID 26593136
2-chloro-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-6-fluorobenzamide
CID 36717455
N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-(trifluoromethyl)benzamide
CID 32738196
N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-cyclohexylacetamide
CID 29373732
N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-3-methylbenzamide
CID 26593186
N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-4-pyrrolidin-1-ylsulfonylbenzamide
CID 5101960
N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-5-pyridin-4-yl-1,2-oxazole-3-carboxamide
CID 112838869
N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-4-(trifluoromethyl)benzamide
CID 26593106
N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-3-(trifluoromethyl)benzamide
CID 26593108
1-(4-chlorophenyl)-N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-3-methylthieno[3,2-d]pyrazole-5-carboxamide
CID 5159788

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-cyclopropyl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-cyclopropyl-1,3-thiazole-5-carboxamide (CID 86891281) is N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-cyclopropyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-cyclopropyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-cyclopropyl-1,3-thiazole-5-carboxamide is O=C(Nc1cccc(S(=O)(=O)Nc2ccccc2Cl)c1)c1cnc(C2CC2)s1.
What is the InChIKey of N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-cyclopropyl-1,3-thiazole-5-carboxamide?
The InChIKey is CZXFVGSVTLUROU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN3O3S2/c20-15-6-1-2-7-16(15)23-28(25,26)14-5-3-4-13(10-14)22-18(24)17-11-21-19(27-17)12-8-9-12/h1-7,10-12,23H,8-9H2,(H,22,24).
What are the key properties of N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-cyclopropyl-1,3-thiazole-5-carboxamide?
N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-cyclopropyl-1,3-thiazole-5-carboxamide has a molecular weight of 433.94 g/mol, XLogP of 4.73, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2-chlorophenyl)sulfamoyl]phenyl]-2-cyclopropyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 86891281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).