N-(5-chloro-2-methoxyphenyl)-4-methyl-1,1-dioxo-5-phenyl-1,2-thiazol-3-amine

C17H15ClN2O3S — CID 22512556

IUPACN-(5-chloro-2-methoxyphenyl)-4-methyl-1,1-dioxo-5-phenyl-1,2-thiazol-3-amine
SMILESCOc1ccc(Cl)cc1NC1=NS(=O)(=O)C(c2ccccc2)=C1C
InChIInChI=1S/C17H15ClN2O3S/c1-11-16(12-6-4-3-5-7-12)24(21,22)20-17(11)19-14-10-13(18)8-9-15(14)23-2/h3-10H,1-2H3,(H,19,20)
InChIKeyBSSCDAUDGOVBER-UHFFFAOYSA-N
MW362.84 g/mol
LogP3.93
Rot. Bonds3

About N-(5-chloro-2-methoxyphenyl)-4-methyl-1,1-dioxo-5-phenyl-1,2-thiazol-3-amine

N-(5-chloro-2-methoxyphenyl)-4-methyl-1,1-dioxo-5-phenyl-1,2-thiazol-3-amine (PubChem CID 22512556) has the molecular formula C17H15ClN2O3S and a molecular weight of 362.84 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-4-methyl-1,1-dioxo-5-phenyl-1,2-thiazol-3-amine.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-4-methyl-1,1-dioxo-5-phenyl-1,2-thiazol-3-amine
PubChem CID22512556
Molecular FormulaC17H15ClN2O3S
Molecular Weight362.84 g/mol
Exact Mass362.05
IUPAC NameN-(5-chloro-2-methoxyphenyl)-4-methyl-1,1-dioxo-5-phenyl-1,2-thiazol-3-amine
SMILESCOc1ccc(Cl)cc1NC1=NS(=O)(=O)C(c2ccccc2)=C1C
InChIInChI=1S/C17H15ClN2O3S/c1-11-16(12-6-4-3-5-7-12)24(21,22)20-17(11)19-14-10-13(18)8-9-15(14)23-2/h3-10H,1-2H3,(H,19,20)
InChIKeyBSSCDAUDGOVBER-UHFFFAOYSA-N
XLogP3.93
TPSA67.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.84
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-chloro-2-methoxyphenyl)-5-(4-fluorophenyl)-4-methyl-1,1-dioxo-1,2-thiazol-3-amine
CID 20934720
N-(4-methoxyphenyl)-4-methyl-1,1-dioxo-5-phenyl-1,2-thiazol-3-amine
CID 22512499
5-(4-chlorophenyl)-N-(4-methoxyphenyl)-4-methyl-1,1-dioxo-1,2-thiazol-3-amine
CID 22512043
5-chloro-2-methoxy-N-(2-methoxyphenyl)aniline
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5-chloro-N-(2-chlorophenyl)-2-methoxyaniline
CID 82536966
N-(5-chloro-2-methoxyphenyl)-4-methylquinolin-2-amine;hydrochloride
CID 56728823
4-N-(5-chloro-2-methoxyphenyl)-2-methyl-6-N-phenylpyrimidine-4,6-diamine
CID 112876894
N-[6-(5-chloro-2-methoxyanilino)pyridazin-3-yl]benzenesulfonamide
CID 113048006
2-(5-chloro-2-methoxyanilino)-N-(2-phenylphenyl)acetamide
CID 26417328
5-chloro-N-(3-chlorophenyl)-2-methoxyaniline
CID 82536935
5-(5-chloro-2-methoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide
CID 109197586
2-N-(5-chloro-2-methoxyphenyl)-4-N,4-N-diethyl-6-phenylpyrimidine-2,4-diamine
CID 112937667

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-4-methyl-1,1-dioxo-5-phenyl-1,2-thiazol-3-amine?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-4-methyl-1,1-dioxo-5-phenyl-1,2-thiazol-3-amine (CID 22512556) is N-(5-chloro-2-methoxyphenyl)-4-methyl-1,1-dioxo-5-phenyl-1,2-thiazol-3-amine.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-4-methyl-1,1-dioxo-5-phenyl-1,2-thiazol-3-amine?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-4-methyl-1,1-dioxo-5-phenyl-1,2-thiazol-3-amine is COc1ccc(Cl)cc1NC1=NS(=O)(=O)C(c2ccccc2)=C1C.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-4-methyl-1,1-dioxo-5-phenyl-1,2-thiazol-3-amine?
The InChIKey is BSSCDAUDGOVBER-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN2O3S/c1-11-16(12-6-4-3-5-7-12)24(21,22)20-17(11)19-14-10-13(18)8-9-15(14)23-2/h3-10H,1-2H3,(H,19,20).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-4-methyl-1,1-dioxo-5-phenyl-1,2-thiazol-3-amine?
N-(5-chloro-2-methoxyphenyl)-4-methyl-1,1-dioxo-5-phenyl-1,2-thiazol-3-amine has a molecular weight of 362.84 g/mol, XLogP of 3.93, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-4-methyl-1,1-dioxo-5-phenyl-1,2-thiazol-3-amine is sourced from PubChem (CID 22512556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).