(2S)-2,4-diphenyl-2H-1,3,5-thiadiazin-6-amine

C15H13N3S — CID 6940266

IUPAC(2S)-2,4-diphenyl-2H-1,3,5-thiadiazin-6-amine
SMILESNC1=NC(c2ccccc2)=N[C@H](c2ccccc2)S1
InChIInChI=1S/C15H13N3S/c16-15-18-13(11-7-3-1-4-8-11)17-14(19-15)12-9-5-2-6-10-12/h1-10,14H,(H2,16,17,18)/t14-/m0/s1
InChIKeyBQAVCRXNKJWKFM-AWEZNQCLSA-N
MW267.36 g/mol
LogP3.19
Rot. Bonds2

About (2S)-2,4-diphenyl-2H-1,3,5-thiadiazin-6-amine

(2S)-2,4-diphenyl-2H-1,3,5-thiadiazin-6-amine (PubChem CID 6940266) has the molecular formula C15H13N3S and a molecular weight of 267.36 g/mol. Its IUPAC name is (2S)-2,4-diphenyl-2H-1,3,5-thiadiazin-6-amine.

Molecular Properties

Compound Name(2S)-2,4-diphenyl-2H-1,3,5-thiadiazin-6-amine
PubChem CID6940266
Molecular FormulaC15H13N3S
Molecular Weight267.36 g/mol
Exact Mass267.08
IUPAC Name(2S)-2,4-diphenyl-2H-1,3,5-thiadiazin-6-amine
SMILESNC1=NC(c2ccccc2)=N[C@H](c2ccccc2)S1
InChIInChI=1S/C15H13N3S/c16-15-18-13(11-7-3-1-4-8-11)17-14(19-15)12-9-5-2-6-10-12/h1-10,14H,(H2,16,17,18)/t14-/m0/s1
InChIKeyBQAVCRXNKJWKFM-AWEZNQCLSA-N
XLogP3.19
TPSA50.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.36
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2,4-diphenyl-2H-1,3,5-thiadiazin-6-amine
CID 6940267
(2R)-2-(4-nitrophenyl)-N,N,4-triphenyl-2H-1,3,5-thiadiazin-6-amine
CID 51715359
2,4,6-triphenyl-2H-1,3,5-triazin-1-amine
CID 151330354
ethane;2,4,5-triphenyl-4H-imidazole
CID 158444509
4-methyl-6-phenyl-6H-1,3-thiazin-2-amine
CID 45096900
3-methyl-6-phenyl-2H-1,3,5-triazine-2,4-diamine
CID 142941536
6-chloro-1-iodo-2,4-diphenyl-2H-1,3,5-triazine
CID 90267623
4-ethyl-5-phenyl-4,5-dihydro-1,3-thiazol-2-amine
CID 13282600
(4S,6S)-6-phenyl-4-(3-pyrimidin-5-ylphenyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 90253357
4-[4-[4-[3-(2,4-diphenyl-1,2-dihydro-1,3,5-triazin-6-yl)phenyl]phenyl]naphthalen-1-yl]aniline
CID 154940521
3,5-diphenyl-2,4-diazabicyclo[4.2.0]octa-2,4-diene
CID 163800958
4-(4-chlorophenyl)-1-methyl-2,6-diphenyl-2H-1,3,5-triazine
CID 170004068

Frequently Asked Questions

What is the IUPAC name of (2S)-2,4-diphenyl-2H-1,3,5-thiadiazin-6-amine?
The IUPAC name of (2S)-2,4-diphenyl-2H-1,3,5-thiadiazin-6-amine (CID 6940266) is (2S)-2,4-diphenyl-2H-1,3,5-thiadiazin-6-amine.
What is the SMILES notation for (2S)-2,4-diphenyl-2H-1,3,5-thiadiazin-6-amine?
The canonical SMILES for (2S)-2,4-diphenyl-2H-1,3,5-thiadiazin-6-amine is NC1=NC(c2ccccc2)=N[C@H](c2ccccc2)S1.
What is the InChIKey of (2S)-2,4-diphenyl-2H-1,3,5-thiadiazin-6-amine?
The InChIKey is BQAVCRXNKJWKFM-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H13N3S/c16-15-18-13(11-7-3-1-4-8-11)17-14(19-15)12-9-5-2-6-10-12/h1-10,14H,(H2,16,17,18)/t14-/m0/s1.
What are the key properties of (2S)-2,4-diphenyl-2H-1,3,5-thiadiazin-6-amine?
(2S)-2,4-diphenyl-2H-1,3,5-thiadiazin-6-amine has a molecular weight of 267.36 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2,4-diphenyl-2H-1,3,5-thiadiazin-6-amine is sourced from PubChem (CID 6940266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).