N-(3,5-dimethylphenyl)-2-methyl-2,3,4,5-tetrahydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine

C18H20N4S — CID 163480567

IUPACN-(3,5-dimethylphenyl)-2-methyl-2,3,4,5-tetrahydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine
SMILESCc1cc(C)cc(Nc2ncc3c(n2)C2=C(CC3)NC(C)S2)c1
InChIInChI=1S/C18H20N4S/c1-10-6-11(2)8-14(7-10)21-18-19-9-13-4-5-15-17(16(13)22-18)23-12(3)20-15/h6-9,12,20H,4-5H2,1-3H3,(H,19,21,22)
InChIKeyCEDWFGJGOCAUPW-UHFFFAOYSA-N
MW324.45 g/mol
LogP4.13
Rot. Bonds2

About N-(3,5-dimethylphenyl)-2-methyl-2,3,4,5-tetrahydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine

N-(3,5-dimethylphenyl)-2-methyl-2,3,4,5-tetrahydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine (PubChem CID 163480567) has the molecular formula C18H20N4S and a molecular weight of 324.45 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-2-methyl-2,3,4,5-tetrahydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-2-methyl-2,3,4,5-tetrahydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine
PubChem CID163480567
Molecular FormulaC18H20N4S
Molecular Weight324.45 g/mol
Exact Mass324.14
IUPAC NameN-(3,5-dimethylphenyl)-2-methyl-2,3,4,5-tetrahydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine
SMILESCc1cc(C)cc(Nc2ncc3c(n2)C2=C(CC3)NC(C)S2)c1
InChIInChI=1S/C18H20N4S/c1-10-6-11(2)8-14(7-10)21-18-19-9-13-4-5-15-17(16(13)22-18)23-12(3)20-15/h6-9,12,20H,4-5H2,1-3H3,(H,19,21,22)
InChIKeyCEDWFGJGOCAUPW-UHFFFAOYSA-N
XLogP4.13
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.45
LogP ≤ 54.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(3,5-dimethylphenyl)-2-methyl-2,3,4,5-tetrahydro-[1,3]thiazolo[4,5-h]quinazolin-8-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

N-(3,5-dimethylphenyl)-2-(morpholin-4-ylmethyl)-2,3,4,5-tetrahydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine
CID 143037319
8-(3-sulfanylanilino)-2,3,4,5-tetrahydro-[1,3]thiazolo[4,5-h]quinazoline-2-carboxylic acid
CID 163919450
N-(3,5-dimethylphenyl)-2-(piperazin-1-ylmethyl)-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine
CID 59262784
9-chloro-N-(3,5-dimethylphenyl)-7-oxido-6,7-dihydro-5H-pyrimido[5,4-d][1]benzazepin-7-ium-2-amine
CID 163796963
1-[4-[8-(3,5-dimethylanilino)-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazoline-2-carbonyl]piperazin-1-yl]ethanone
CID 59262915
8-methoxy-N-(4-methoxyphenyl)-5,6-dihydrobenzo[h]quinazolin-2-amine
CID 18918768
5-bromo-4-N-(5-cyclopropyl-1H-pyrazol-3-yl)-2-N-(3,5-dimethylphenyl)pyrimidine-2,4-diamine
CID 59757986
5-bromo-N-(3,5-dimethylphenyl)pyrimidin-2-amine
CID 63874390
2-methyl-N-[4-(trifluoromethyl)phenyl]-4,5-dihydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine
CID 11428427
N-(3,5-dimethylphenyl)-4,6-dimethyl-1,3,5-triazin-2-amine
CID 134173031
2-(3,5-dimethylanilino)-7,8-dihydro-6H-quinazolin-5-one
CID 665694
7-methyl-N-(3-methylphenyl)-5,6-dihydropyrido[3,4-h]quinazolin-2-amine;pentane
CID 143712249

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-2-methyl-2,3,4,5-tetrahydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine?
The IUPAC name of N-(3,5-dimethylphenyl)-2-methyl-2,3,4,5-tetrahydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine (CID 163480567) is N-(3,5-dimethylphenyl)-2-methyl-2,3,4,5-tetrahydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine.
What is the SMILES notation for N-(3,5-dimethylphenyl)-2-methyl-2,3,4,5-tetrahydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine?
The canonical SMILES for N-(3,5-dimethylphenyl)-2-methyl-2,3,4,5-tetrahydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine is Cc1cc(C)cc(Nc2ncc3c(n2)C2=C(CC3)NC(C)S2)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-2-methyl-2,3,4,5-tetrahydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine?
The InChIKey is CEDWFGJGOCAUPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4S/c1-10-6-11(2)8-14(7-10)21-18-19-9-13-4-5-15-17(16(13)22-18)23-12(3)20-15/h6-9,12,20H,4-5H2,1-3H3,(H,19,21,22).
What are the key properties of N-(3,5-dimethylphenyl)-2-methyl-2,3,4,5-tetrahydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine?
N-(3,5-dimethylphenyl)-2-methyl-2,3,4,5-tetrahydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine has a molecular weight of 324.45 g/mol, XLogP of 4.13, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-2-methyl-2,3,4,5-tetrahydro-[1,3]thiazolo[4,5-h]quinazolin-8-amine is sourced from PubChem (CID 163480567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).