4-naphthalen-2-yl-2-phenyl-1,3-thiazole

C19H13NS — CID 7573709

IUPAC4-naphthalen-2-yl-2-phenyl-1,3-thiazole
SMILESc1ccc(-c2nc(-c3ccc4ccccc4c3)cs2)cc1
InChIInChI=1S/C19H13NS/c1-2-7-15(8-3-1)19-20-18(13-21-19)17-11-10-14-6-4-5-9-16(14)12-17/h1-13H
InChIKeyIWQFEDAECCKMKK-UHFFFAOYSA-N
MW287.39 g/mol
LogP5.63
Rot. Bonds2

About 4-naphthalen-2-yl-2-phenyl-1,3-thiazole

4-naphthalen-2-yl-2-phenyl-1,3-thiazole (PubChem CID 7573709) has the molecular formula C19H13NS and a molecular weight of 287.39 g/mol. Its IUPAC name is 4-naphthalen-2-yl-2-phenyl-1,3-thiazole.

Molecular Properties

Compound Name4-naphthalen-2-yl-2-phenyl-1,3-thiazole
PubChem CID7573709
Molecular FormulaC19H13NS
Molecular Weight287.39 g/mol
Exact Mass287.08
IUPAC Name4-naphthalen-2-yl-2-phenyl-1,3-thiazole
SMILESc1ccc(-c2nc(-c3ccc4ccccc4c3)cs2)cc1
InChIInChI=1S/C19H13NS/c1-2-7-15(8-3-1)19-20-18(13-21-19)17-11-10-14-6-4-5-9-16(14)12-17/h1-13H
InChIKeyIWQFEDAECCKMKK-UHFFFAOYSA-N
XLogP5.63
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500287.39
LogP ≤ 55.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Methyl-4-phenyl-1,3-thiazole
CID 584377
4-(2-Naphthyl)-1,3-thiazol-2-amine
CID 673702
2-Amino-4-(5,6,7,8-tetrahydro-2-naphthyl)thiazole
CID 735091
4-(Naphthalen-1-yl)-2-aminothiazole
CID 151342
2-Methyl-4-(4-methylphenyl)-1,3-thiazole
CID 667561
4-(2,4-Dimethylphenyl)-2-methyl-1,3-thiazole
CID 2798044
5-Methylsulfanyl-4-(4-naphthalen-2-yl-thiazol-2-yl)-thiophene-2-carboxamidine
CID 18537298
Thiazole, triphenyl-
CID 1712256
4-(1-Adamantyl)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazole
CID 2747365
2-(2,3-Difluorophenyl)-4-phenyl-1,3-thiazole
CID 71459803
2-Phenyl-4-(4-(trifluoromethyl)phenyl)thiazole
CID 46911999
4-(3,4-Difluorophenyl)-2-[4-(1,3-dithiolan-2-yl)phenyl]-1,3-thiazole
CID 2742427

Frequently Asked Questions

What is the IUPAC name of 4-naphthalen-2-yl-2-phenyl-1,3-thiazole?
The IUPAC name of 4-naphthalen-2-yl-2-phenyl-1,3-thiazole (CID 7573709) is 4-naphthalen-2-yl-2-phenyl-1,3-thiazole.
What is the SMILES notation for 4-naphthalen-2-yl-2-phenyl-1,3-thiazole?
The canonical SMILES for 4-naphthalen-2-yl-2-phenyl-1,3-thiazole is c1ccc(-c2nc(-c3ccc4ccccc4c3)cs2)cc1.
What is the InChIKey of 4-naphthalen-2-yl-2-phenyl-1,3-thiazole?
The InChIKey is IWQFEDAECCKMKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13NS/c1-2-7-15(8-3-1)19-20-18(13-21-19)17-11-10-14-6-4-5-9-16(14)12-17/h1-13H.
What are the key properties of 4-naphthalen-2-yl-2-phenyl-1,3-thiazole?
4-naphthalen-2-yl-2-phenyl-1,3-thiazole has a molecular weight of 287.39 g/mol, XLogP of 5.63, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-naphthalen-2-yl-2-phenyl-1,3-thiazole is sourced from PubChem (CID 7573709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).