N-(2-chlorophenyl)-2,3-dihydro-1,4-benzothiazine-4-carboxamide

C15H13ClN2OS — CID 1478238

IUPACN-(2-chlorophenyl)-2,3-dihydro-1,4-benzothiazine-4-carboxamide
SMILESO=C(Nc1ccccc1Cl)N1CCSc2ccccc21
InChIInChI=1S/C15H13ClN2OS/c16-11-5-1-2-6-12(11)17-15(19)18-9-10-20-14-8-4-3-7-13(14)18/h1-8H,9-10H2,(H,17,19)
InChIKeyIASWZMZMNRDQOI-UHFFFAOYSA-N
MW304.80 g/mol
LogP4.48
Rot. Bonds1

About N-(2-chlorophenyl)-2,3-dihydro-1,4-benzothiazine-4-carboxamide

N-(2-chlorophenyl)-2,3-dihydro-1,4-benzothiazine-4-carboxamide (PubChem CID 1478238) has the molecular formula C15H13ClN2OS and a molecular weight of 304.80 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2,3-dihydro-1,4-benzothiazine-4-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2,3-dihydro-1,4-benzothiazine-4-carboxamide
PubChem CID1478238
Molecular FormulaC15H13ClN2OS
Molecular Weight304.80 g/mol
Exact Mass304.04
IUPAC NameN-(2-chlorophenyl)-2,3-dihydro-1,4-benzothiazine-4-carboxamide
SMILESO=C(Nc1ccccc1Cl)N1CCSc2ccccc21
InChIInChI=1S/C15H13ClN2OS/c16-11-5-1-2-6-12(11)17-15(19)18-9-10-20-14-8-4-3-7-13(14)18/h1-8H,9-10H2,(H,17,19)
InChIKeyIASWZMZMNRDQOI-UHFFFAOYSA-N
XLogP4.48
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.80
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-propan-2-ylphenothiazine-10-carboxamide
CID 704259
N-propyl-10H-phenothiazine-10-carboxamide
CID 1991974
N-butan-2-ylphenothiazine-10-carboxamide
CID 5150646
N-(4-chlorophenyl)-2,3-dihydro-4H-1,4-benzothiazine-4-carboxamide
CID 1478240
N-(4-chlorophenyl)thiomorpholine-4-carboxamide
CID 757063
N-(2-Chlorophenyl)-3,4-dihydro-3-oxo-2H-1,4-benzothiazine-2-acetamide
CID 600993
N-Methyl-10H-phenothiazine-10-carboxamide
CID 19916609
N-allyl-10H-phenothiazine-10-carboxamide
CID 1865633
N-(2-(Diethylamino)ethyl)-10H-phenothiazine-10-carboxamide monohydrochloride
CID 3029940
7-chloro-N-(3-chlorophenyl)-2,3-dihydro-4H-1,4-benzothiazine-4-carboxamide
CID 3585771
7-chloro-N-phenyl-2,3-dihydro-4H-1,4-benzothiazine-4-carboxamide
CID 3693567
N-[4-[4-(4-aminobutylamino)butylamino]butyl]phenothiazine-10-carboxamide
CID 44426123

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2,3-dihydro-1,4-benzothiazine-4-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-2,3-dihydro-1,4-benzothiazine-4-carboxamide (CID 1478238) is N-(2-chlorophenyl)-2,3-dihydro-1,4-benzothiazine-4-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-2,3-dihydro-1,4-benzothiazine-4-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-2,3-dihydro-1,4-benzothiazine-4-carboxamide is O=C(Nc1ccccc1Cl)N1CCSc2ccccc21.
What is the InChIKey of N-(2-chlorophenyl)-2,3-dihydro-1,4-benzothiazine-4-carboxamide?
The InChIKey is IASWZMZMNRDQOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN2OS/c16-11-5-1-2-6-12(11)17-15(19)18-9-10-20-14-8-4-3-7-13(14)18/h1-8H,9-10H2,(H,17,19).
What are the key properties of N-(2-chlorophenyl)-2,3-dihydro-1,4-benzothiazine-4-carboxamide?
N-(2-chlorophenyl)-2,3-dihydro-1,4-benzothiazine-4-carboxamide has a molecular weight of 304.80 g/mol, XLogP of 4.48, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2,3-dihydro-1,4-benzothiazine-4-carboxamide is sourced from PubChem (CID 1478238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).