2-(2-methylquinolin-4-yl)-4-phenyl-1,3-thiazole

C19H14N2S — CID 103597581

IUPAC2-(2-methylquinolin-4-yl)-4-phenyl-1,3-thiazole
SMILESCc1cc(-c2nc(-c3ccccc3)cs2)c2ccccc2n1
InChIInChI=1S/C19H14N2S/c1-13-11-16(15-9-5-6-10-17(15)20-13)19-21-18(12-22-19)14-7-3-2-4-8-14/h2-12H,1H3
InChIKeyKXODTQBUILZXCH-UHFFFAOYSA-N
MW302.40 g/mol
LogP5.33
Rot. Bonds2

About 2-(2-methylquinolin-4-yl)-4-phenyl-1,3-thiazole

2-(2-methylquinolin-4-yl)-4-phenyl-1,3-thiazole (PubChem CID 103597581) has the molecular formula C19H14N2S and a molecular weight of 302.40 g/mol. Its IUPAC name is 2-(2-methylquinolin-4-yl)-4-phenyl-1,3-thiazole.

Molecular Properties

Compound Name2-(2-methylquinolin-4-yl)-4-phenyl-1,3-thiazole
PubChem CID103597581
Molecular FormulaC19H14N2S
Molecular Weight302.40 g/mol
Exact Mass302.09
IUPAC Name2-(2-methylquinolin-4-yl)-4-phenyl-1,3-thiazole
SMILESCc1cc(-c2nc(-c3ccccc3)cs2)c2ccccc2n1
InChIInChI=1S/C19H14N2S/c1-13-11-16(15-9-5-6-10-17(15)20-13)19-21-18(12-22-19)14-7-3-2-4-8-14/h2-12H,1H3
InChIKeyKXODTQBUILZXCH-UHFFFAOYSA-N
XLogP5.33
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.40
LogP ≤ 55.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methylquinolin-4-yl)-1,3-thiazole-4-carbaldehyde
CID 79235363
2,6-dimethoxy-3-[2-(2-methylquinolin-4-yl)-1,3-thiazol-4-yl]phenol
CID 103597586
4-methyl-2-(4-phenyl-1,3-thiazol-2-yl)phenol
CID 142708641
2-methyl-4-thiophen-2-ylquinoline
CID 11746306
N-methyl-5-(2-methylquinolin-4-yl)-1,3,4-thiadiazol-2-amine
CID 82447733
2-[2-(4-tert-butylnaphthalen-2-yl)quinolin-4-yl]-4-methyl-1,3-thiazole
CID 156665321
3-(2-methylquinolin-4-yl)-1,2,4-thiadiazol-5-amine
CID 79235359
2-(2-methoxy-5-methylphenyl)-4-phenyl-1,3-thiazole
CID 142708637
2-methylquinolin-4-amine
CID 162035180
1-[2-(2-methylquinolin-4-yl)-1,3-thiazol-5-yl]ethanamine
CID 79235133
3-[2-(2,6-dimethyl-4-pyridinyl)-1,3-thiazol-4-yl]aniline
CID 107504187
2-[3-(2-methylquinolin-4-yl)phenyl]acetic acid
CID 155909496

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylquinolin-4-yl)-4-phenyl-1,3-thiazole?
The IUPAC name of 2-(2-methylquinolin-4-yl)-4-phenyl-1,3-thiazole (CID 103597581) is 2-(2-methylquinolin-4-yl)-4-phenyl-1,3-thiazole.
What is the SMILES notation for 2-(2-methylquinolin-4-yl)-4-phenyl-1,3-thiazole?
The canonical SMILES for 2-(2-methylquinolin-4-yl)-4-phenyl-1,3-thiazole is Cc1cc(-c2nc(-c3ccccc3)cs2)c2ccccc2n1.
What is the InChIKey of 2-(2-methylquinolin-4-yl)-4-phenyl-1,3-thiazole?
The InChIKey is KXODTQBUILZXCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2S/c1-13-11-16(15-9-5-6-10-17(15)20-13)19-21-18(12-22-19)14-7-3-2-4-8-14/h2-12H,1H3.
What are the key properties of 2-(2-methylquinolin-4-yl)-4-phenyl-1,3-thiazole?
2-(2-methylquinolin-4-yl)-4-phenyl-1,3-thiazole has a molecular weight of 302.40 g/mol, XLogP of 5.33, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylquinolin-4-yl)-4-phenyl-1,3-thiazole is sourced from PubChem (CID 103597581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).