4-[6-[6-(2,2-difluoroethoxy)-4-methyl-2-pyridinyl]-5-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-1,3-thiazole

C19H19F2N5OS — CID 142340807

IUPAC4-[6-[6-(2,2-difluoroethoxy)-4-methyl-2-pyridinyl]-5-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-1,3-thiazole
SMILESCc1cc(OCC(F)F)nc(N2CCc3nc(-c4cscn4)ncc3C2C)c1
InChIInChI=1S/C19H19F2N5OS/c1-11-5-17(25-18(6-11)27-8-16(20)21)26-4-3-14-13(12(26)2)7-22-19(24-14)15-9-28-10-23-15/h5-7,9-10,12,16H,3-4,8H2,1-2H3
InChIKeyCZQRRISJXAQQBE-UHFFFAOYSA-N
MW403.46 g/mol
LogP4.07
Rot. Bonds5

About 4-[6-[6-(2,2-difluoroethoxy)-4-methyl-2-pyridinyl]-5-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-1,3-thiazole

4-[6-[6-(2,2-difluoroethoxy)-4-methyl-2-pyridinyl]-5-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-1,3-thiazole (PubChem CID 142340807) has the molecular formula C19H19F2N5OS and a molecular weight of 403.46 g/mol. Its IUPAC name is 4-[6-[6-(2,2-difluoroethoxy)-4-methyl-2-pyridinyl]-5-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-1,3-thiazole.

Molecular Properties

Compound Name4-[6-[6-(2,2-difluoroethoxy)-4-methyl-2-pyridinyl]-5-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-1,3-thiazole
PubChem CID142340807
Molecular FormulaC19H19F2N5OS
Molecular Weight403.46 g/mol
Exact Mass403.13
IUPAC Name4-[6-[6-(2,2-difluoroethoxy)-4-methyl-2-pyridinyl]-5-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-1,3-thiazole
SMILESCc1cc(OCC(F)F)nc(N2CCc3nc(-c4cscn4)ncc3C2C)c1
InChIInChI=1S/C19H19F2N5OS/c1-11-5-17(25-18(6-11)27-8-16(20)21)26-4-3-14-13(12(26)2)7-22-19(24-14)15-9-28-10-23-15/h5-7,9-10,12,16H,3-4,8H2,1-2H3
InChIKeyCZQRRISJXAQQBE-UHFFFAOYSA-N
XLogP4.07
TPSA64.03 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.46
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-[6-[6-(2,2-difluoroethoxy)-4-methyl-2-pyridinyl]-5-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-1,3-thiazole 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

4-[6-[4-(2,2-difluoroethoxy)-6-methyl-2-pyridinyl]-5-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-1,3-thiazole
CID 142340826
4-[6-(4,6-difluoro-2-pyridinyl)-5-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-1,3-thiazole
CID 139461644
2-fluoro-N,N-dimethyl-6-[5-methyl-2-(1,3-thiazol-4-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]pyridin-4-amine
CID 139461623
4-[2-methyl-6-[5-methyl-2-(1,3-thiazol-4-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-4-pyridinyl]piperazin-2-one
CID 142340816
6-[2-(2,2-difluoroethoxy)-6-fluoro-4-pyridinyl]-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine;6-[4-(2,2-difluoroethoxy)-6-fluoro-2-pyridinyl]-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine;6-[6-(2,2-difluoroethoxy)-4-fluoro-2-pyridinyl]-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 158203809
1-[3-[[2-fluoro-6-[5-methyl-2-(1,3-thiazol-4-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-4-pyridinyl]oxy]propyl]pyrrolidin-2-one;1-[3-[[6-fluoro-4-[5-methyl-2-(1,3-thiazol-4-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]-2-pyridinyl]oxy]propyl]pyrrolidin-2-one
CID 158601169
2-[4-[4-methyl-6-(5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-2-pyridinyl]piperazin-1-yl]acetamide
CID 145427351
(5S)-6-(6-fluoro-4-methoxy-2-pyridinyl)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 122681023
(5R)-6-(3,4-difluoro-5-methoxyphenyl)-5-methyl-2-pyridin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine;(5S)-6-(3,4-difluoro-5-methoxyphenyl)-5-methyl-2-pyridin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 158354926
4-fluoro-N,N-dimethyl-6-[(5R)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]pyridin-2-amine
CID 122681038
3-[6-[6-fluoro-4-(3-methoxypyrrolidin-1-yl)-2-pyridinyl]-5-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-1,2,5-thiadiazole
CID 175702696
6-[3-(difluoromethoxy)-4,5-difluorophenyl]-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 122669949

Frequently Asked Questions

What is the IUPAC name of 4-[6-[6-(2,2-difluoroethoxy)-4-methyl-2-pyridinyl]-5-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-1,3-thiazole?
The IUPAC name of 4-[6-[6-(2,2-difluoroethoxy)-4-methyl-2-pyridinyl]-5-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-1,3-thiazole (CID 142340807) is 4-[6-[6-(2,2-difluoroethoxy)-4-methyl-2-pyridinyl]-5-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-1,3-thiazole.
What is the SMILES notation for 4-[6-[6-(2,2-difluoroethoxy)-4-methyl-2-pyridinyl]-5-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-1,3-thiazole?
The canonical SMILES for 4-[6-[6-(2,2-difluoroethoxy)-4-methyl-2-pyridinyl]-5-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-1,3-thiazole is Cc1cc(OCC(F)F)nc(N2CCc3nc(-c4cscn4)ncc3C2C)c1.
What is the InChIKey of 4-[6-[6-(2,2-difluoroethoxy)-4-methyl-2-pyridinyl]-5-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-1,3-thiazole?
The InChIKey is CZQRRISJXAQQBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F2N5OS/c1-11-5-17(25-18(6-11)27-8-16(20)21)26-4-3-14-13(12(26)2)7-22-19(24-14)15-9-28-10-23-15/h5-7,9-10,12,16H,3-4,8H2,1-2H3.
What are the key properties of 4-[6-[6-(2,2-difluoroethoxy)-4-methyl-2-pyridinyl]-5-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-1,3-thiazole?
4-[6-[6-(2,2-difluoroethoxy)-4-methyl-2-pyridinyl]-5-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-1,3-thiazole has a molecular weight of 403.46 g/mol, XLogP of 4.07, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-[6-(2,2-difluoroethoxy)-4-methyl-2-pyridinyl]-5-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl]-1,3-thiazole is sourced from PubChem (CID 142340807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).