4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)quinazolin-2-amine

C13H16N4O2S — CID 102887639

IUPAC4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)quinazolin-2-amine
SMILESCC1CS(=O)(=O)CCN1c1nc(N)nc2ccccc12
InChIInChI=1S/C13H16N4O2S/c1-9-8-20(18,19)7-6-17(9)12-10-4-2-3-5-11(10)15-13(14)16-12/h2-5,9H,6-8H2,1H3,(H2,14,15,16)
InChIKeyZNXWDHZMJREYTH-UHFFFAOYSA-N
MW292.36 g/mol
LogP0.84
Rot. Bonds1

About 4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)quinazolin-2-amine

4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)quinazolin-2-amine (PubChem CID 102887639) has the molecular formula C13H16N4O2S and a molecular weight of 292.36 g/mol. Its IUPAC name is 4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)quinazolin-2-amine.

Molecular Properties

Compound Name4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)quinazolin-2-amine
PubChem CID102887639
Molecular FormulaC13H16N4O2S
Molecular Weight292.36 g/mol
Exact Mass292.10
IUPAC Name4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)quinazolin-2-amine
SMILESCC1CS(=O)(=O)CCN1c1nc(N)nc2ccccc12
InChIInChI=1S/C13H16N4O2S/c1-9-8-20(18,19)7-6-17(9)12-10-4-2-3-5-11(10)15-13(14)16-12/h2-5,9H,6-8H2,1H3,(H2,14,15,16)
InChIKeyZNXWDHZMJREYTH-UHFFFAOYSA-N
XLogP0.84
TPSA89.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)quinazolin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)isoquinolin-3-yl]methanol
CID 102885836
3,5-difluoro-6-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyridin-2-amine
CID 114074771
2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)quinoline-3-carbonitrile
CID 102883404
[2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-3-pyridinyl]methanamine
CID 102882640
4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-6-(trifluoromethyl)pyrimidin-2-amine
CID 102887762
2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridine-3-carboxylic acid
CID 102883872
1-(2-aminoquinazolin-4-yl)pyrrolidine-2-carboxamide
CID 80765389
6-chloro-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)pyridine-3-carboxylic acid
CID 102883883
4-pyrrolidin-1-ylquinazolin-2-amine
CID 57342786
3-methyl-4-(3,5,6-trichloro-2-pyridinyl)-1,4-thiazinane 1,1-dioxide
CID 102885437
2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,2-a]pyridine-3-carbaldehyde
CID 102884295
4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 102887749

Frequently Asked Questions

What is the IUPAC name of 4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)quinazolin-2-amine?
The IUPAC name of 4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)quinazolin-2-amine (CID 102887639) is 4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)quinazolin-2-amine.
What is the SMILES notation for 4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)quinazolin-2-amine?
The canonical SMILES for 4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)quinazolin-2-amine is CC1CS(=O)(=O)CCN1c1nc(N)nc2ccccc12.
What is the InChIKey of 4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)quinazolin-2-amine?
The InChIKey is ZNXWDHZMJREYTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2S/c1-9-8-20(18,19)7-6-17(9)12-10-4-2-3-5-11(10)15-13(14)16-12/h2-5,9H,6-8H2,1H3,(H2,14,15,16).
What are the key properties of 4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)quinazolin-2-amine?
4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)quinazolin-2-amine has a molecular weight of 292.36 g/mol, XLogP of 0.84, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)quinazolin-2-amine is sourced from PubChem (CID 102887639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).