4-methyl-6-phenyl-2-thiophen-2-yl-[1,3]thiazolo[5,4-c]pyridine

C17H12N2S2 — CID 11833804

IUPAC4-methyl-6-phenyl-2-thiophen-2-yl-[1,3]thiazolo[5,4-c]pyridine
SMILESCc1nc(-c2ccccc2)cc2nc(-c3cccs3)sc12
InChIInChI=1S/C17H12N2S2/c1-11-16-14(19-17(21-16)15-8-5-9-20-15)10-13(18-11)12-6-3-2-4-7-12/h2-10H,1H3
InChIKeyPBCMBOIGAORNCZ-UHFFFAOYSA-N
MW308.43 g/mol
LogP5.40
Rot. Bonds2

About 4-methyl-6-phenyl-2-thiophen-2-yl-[1,3]thiazolo[5,4-c]pyridine

4-methyl-6-phenyl-2-thiophen-2-yl-[1,3]thiazolo[5,4-c]pyridine (PubChem CID 11833804) has the molecular formula C17H12N2S2 and a molecular weight of 308.43 g/mol. Its IUPAC name is 4-methyl-6-phenyl-2-thiophen-2-yl-[1,3]thiazolo[5,4-c]pyridine.

Molecular Properties

Compound Name4-methyl-6-phenyl-2-thiophen-2-yl-[1,3]thiazolo[5,4-c]pyridine
PubChem CID11833804
Molecular FormulaC17H12N2S2
Molecular Weight308.43 g/mol
Exact Mass308.04
IUPAC Name4-methyl-6-phenyl-2-thiophen-2-yl-[1,3]thiazolo[5,4-c]pyridine
SMILESCc1nc(-c2ccccc2)cc2nc(-c3cccs3)sc12
InChIInChI=1S/C17H12N2S2/c1-11-16-14(19-17(21-16)15-8-5-9-20-15)10-13(18-11)12-6-3-2-4-7-12/h2-10H,1H3
InChIKeyPBCMBOIGAORNCZ-UHFFFAOYSA-N
XLogP5.40
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500308.43
LogP ≤ 55.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-Phenylbenzothiazole
CID 13439
2-(Butane-1-sulfinyl)-4-phenyl-6-(thiophen-2-yl)thieno(2,3-b)pyridin-3-amine
CID 3337839
Mls000737657
CID 233874
AE-641/00355019
CID 826449
Benzothiazole, 2,2'-methylenebis-
CID 74755
(R)-4-methyl-5-(6-(2-(2-methylpyrrolidin-1-yl)ethyl)quinolin-2-yl)-2-(thiophen-2-yl)thiazole
CID 11640354
2-Butylsulfinyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-amine
CID 72188205
2-(4-Tert-butylphenyl)-1,3-benzothiazole
CID 709072
2-(4-Methylphenyl)-1,3-benzothiazole
CID 919385
2-(Butane-1-sulfonyl)-4-phenyl-6-(thiophen-2-YL)thieno[2,3-B]pyridin-3-amine
CID 3337991
Benzothiazole, 2,2'-ethylenebis-
CID 13760
3-Amino-6-(thiophen-2-yl)thieno[2,3-b]pyridine-2-carbonitrile
CID 690882

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-phenyl-2-thiophen-2-yl-[1,3]thiazolo[5,4-c]pyridine?
The IUPAC name of 4-methyl-6-phenyl-2-thiophen-2-yl-[1,3]thiazolo[5,4-c]pyridine (CID 11833804) is 4-methyl-6-phenyl-2-thiophen-2-yl-[1,3]thiazolo[5,4-c]pyridine.
What is the SMILES notation for 4-methyl-6-phenyl-2-thiophen-2-yl-[1,3]thiazolo[5,4-c]pyridine?
The canonical SMILES for 4-methyl-6-phenyl-2-thiophen-2-yl-[1,3]thiazolo[5,4-c]pyridine is Cc1nc(-c2ccccc2)cc2nc(-c3cccs3)sc12.
What is the InChIKey of 4-methyl-6-phenyl-2-thiophen-2-yl-[1,3]thiazolo[5,4-c]pyridine?
The InChIKey is PBCMBOIGAORNCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2S2/c1-11-16-14(19-17(21-16)15-8-5-9-20-15)10-13(18-11)12-6-3-2-4-7-12/h2-10H,1H3.
What are the key properties of 4-methyl-6-phenyl-2-thiophen-2-yl-[1,3]thiazolo[5,4-c]pyridine?
4-methyl-6-phenyl-2-thiophen-2-yl-[1,3]thiazolo[5,4-c]pyridine has a molecular weight of 308.43 g/mol, XLogP of 5.40, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-phenyl-2-thiophen-2-yl-[1,3]thiazolo[5,4-c]pyridine is sourced from PubChem (CID 11833804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).