(6S)-6-(2-chlorophenyl)-4-(4-methylphenyl)-6H-1,3-thiazin-2-amine

C17H15ClN2S — CID 7912962

IUPAC(6S)-6-(2-chlorophenyl)-4-(4-methylphenyl)-6H-1,3-thiazin-2-amine
SMILESCc1ccc(C2=C[C@@H](c3ccccc3Cl)SC(N)=N2)cc1
InChIInChI=1S/C17H15ClN2S/c1-11-6-8-12(9-7-11)15-10-16(21-17(19)20-15)13-4-2-3-5-14(13)18/h2-10,16H,1H3,(H2,19,20)/t16-/m0/s1
InChIKeyNFKXKHOFPYWOSP-INIZCTEOSA-N
MW314.84 g/mol
LogP4.79
Rot. Bonds2

About (6S)-6-(2-chlorophenyl)-4-(4-methylphenyl)-6H-1,3-thiazin-2-amine

(6S)-6-(2-chlorophenyl)-4-(4-methylphenyl)-6H-1,3-thiazin-2-amine (PubChem CID 7912962) has the molecular formula C17H15ClN2S and a molecular weight of 314.84 g/mol. Its IUPAC name is (6S)-6-(2-chlorophenyl)-4-(4-methylphenyl)-6H-1,3-thiazin-2-amine.

Molecular Properties

Compound Name(6S)-6-(2-chlorophenyl)-4-(4-methylphenyl)-6H-1,3-thiazin-2-amine
PubChem CID7912962
Molecular FormulaC17H15ClN2S
Molecular Weight314.84 g/mol
Exact Mass314.06
IUPAC Name(6S)-6-(2-chlorophenyl)-4-(4-methylphenyl)-6H-1,3-thiazin-2-amine
SMILESCc1ccc(C2=C[C@@H](c3ccccc3Cl)SC(N)=N2)cc1
InChIInChI=1S/C17H15ClN2S/c1-11-6-8-12(9-7-11)15-10-16(21-17(19)20-15)13-4-2-3-5-14(13)18/h2-10,16H,1H3,(H2,19,20)/t16-/m0/s1
InChIKeyNFKXKHOFPYWOSP-INIZCTEOSA-N
XLogP4.79
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.84
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(4-chlorophenyl)-4-(4-fluorophenyl)-6H-1,3-thiazin-2-amine
CID 3604744
4-(4-chlorophenyl)-6-(4-fluorophenyl)-6H-1,3-thiazin-2-amine
CID 3740915
(5R)-2-amino-5-(2-chlorophenyl)-1,3-thiazol-4-one
CID 40510286
2-(2-chlorophenyl)-4-(4-chlorophenyl)-8-methyl-2,5-dihydro-1,5-benzothiazepine
CID 25146455
4-methyl-6-phenyl-6H-1,3-thiazin-2-amine
CID 45096900
4-methyl-2-(4-methylphenyl)-4H-3,1-benzothiazine
CID 10800880
2-[(2S,6S)-2-(2-chlorophenyl)-4-(4-methylphenyl)-1,2,5,6-tetrahydropyrimidin-6-yl]phenol
CID 92697881
2-[(2S,6R)-2-(2-chlorophenyl)-4-(4-methylphenyl)-1,2,5,6-tetrahydropyrimidin-6-yl]phenol
CID 92697879
7-(2-chlorophenyl)-5-(4-methylphenyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-amine
CID 3844422
1,2-dichlorobenzene;1-methoxy-4-methylbenzene
CID 158750380
4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridazine-3,5-dicarboxylic acid
CID 21163013
lithium;2-chloroaniline;hydride
CID 175102448

Frequently Asked Questions

What is the IUPAC name of (6S)-6-(2-chlorophenyl)-4-(4-methylphenyl)-6H-1,3-thiazin-2-amine?
The IUPAC name of (6S)-6-(2-chlorophenyl)-4-(4-methylphenyl)-6H-1,3-thiazin-2-amine (CID 7912962) is (6S)-6-(2-chlorophenyl)-4-(4-methylphenyl)-6H-1,3-thiazin-2-amine.
What is the SMILES notation for (6S)-6-(2-chlorophenyl)-4-(4-methylphenyl)-6H-1,3-thiazin-2-amine?
The canonical SMILES for (6S)-6-(2-chlorophenyl)-4-(4-methylphenyl)-6H-1,3-thiazin-2-amine is Cc1ccc(C2=C[C@@H](c3ccccc3Cl)SC(N)=N2)cc1.
What is the InChIKey of (6S)-6-(2-chlorophenyl)-4-(4-methylphenyl)-6H-1,3-thiazin-2-amine?
The InChIKey is NFKXKHOFPYWOSP-INIZCTEOSA-N. The full InChI is InChI=1S/C17H15ClN2S/c1-11-6-8-12(9-7-11)15-10-16(21-17(19)20-15)13-4-2-3-5-14(13)18/h2-10,16H,1H3,(H2,19,20)/t16-/m0/s1.
What are the key properties of (6S)-6-(2-chlorophenyl)-4-(4-methylphenyl)-6H-1,3-thiazin-2-amine?
(6S)-6-(2-chlorophenyl)-4-(4-methylphenyl)-6H-1,3-thiazin-2-amine has a molecular weight of 314.84 g/mol, XLogP of 4.79, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-6-(2-chlorophenyl)-4-(4-methylphenyl)-6H-1,3-thiazin-2-amine is sourced from PubChem (CID 7912962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).