1,5-dimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]-3-propylthieno[2,3-d]pyrimidine-2,4-dione

C15H19N3O3S — CID 69321223

IUPAC1,5-dimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]-3-propylthieno[2,3-d]pyrimidine-2,4-dione
SMILESCCCn1c(=O)c2c(C)c(C3=N[C@H](C)CO3)sc2n(C)c1=O
InChIInChI=1S/C15H19N3O3S/c1-5-6-18-13(19)10-9(3)11(12-16-8(2)7-21-12)22-14(10)17(4)15(18)20/h8H,5-7H2,1-4H3/t8-/m1/s1
InChIKeyUXKMCULOVXGNKW-MRVPVSSYSA-N
MW321.40 g/mol
LogP1.65
Rot. Bonds3

About 1,5-dimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]-3-propylthieno[2,3-d]pyrimidine-2,4-dione

1,5-dimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]-3-propylthieno[2,3-d]pyrimidine-2,4-dione (PubChem CID 69321223) has the molecular formula C15H19N3O3S and a molecular weight of 321.40 g/mol. Its IUPAC name is 1,5-dimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]-3-propylthieno[2,3-d]pyrimidine-2,4-dione.

Molecular Properties

Compound Name1,5-dimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]-3-propylthieno[2,3-d]pyrimidine-2,4-dione
PubChem CID69321223
Molecular FormulaC15H19N3O3S
Molecular Weight321.40 g/mol
Exact Mass321.11
IUPAC Name1,5-dimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]-3-propylthieno[2,3-d]pyrimidine-2,4-dione
SMILESCCCn1c(=O)c2c(C)c(C3=N[C@H](C)CO3)sc2n(C)c1=O
InChIInChI=1S/C15H19N3O3S/c1-5-6-18-13(19)10-9(3)11(12-16-8(2)7-21-12)22-14(10)17(4)15(18)20/h8H,5-7H2,1-4H3/t8-/m1/s1
InChIKeyUXKMCULOVXGNKW-MRVPVSSYSA-N
XLogP1.65
TPSA65.59 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.40
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 1,5-dimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]-3-propylthieno[2,3-d]pyrimidine-2,4-dione with MolForge

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Related Compounds

6-[(4S)-4-ethyl-4,5-dihydro-1,3-oxazol-2-yl]-1,5-dimethyl-3-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-dione
CID 24757214
1,5-dimethyl-6-[(5R)-5-methyl-4,5-dihydro-1,3-oxazol-2-yl]-3-(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-dione
CID 24757137
1,5-dimethyl-3-(2-methylpropyl)-6-(1,3-oxazol-2-yl)thieno[2,3-d]pyrimidine-2,4-dione
CID 24757308
6-(2-fluoro-3-methylphenyl)-3-(3-hydroxypropyl)-1,5-dimethylthieno[2,3-d]pyrimidine-2,4-dione
CID 122543915
6-bromo-3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-1,5-dimethylthieno[2,3-d]pyrimidine-2,4-dione
CID 131737210
1,5,6-trimethyl-3-[(1S,2S)-2-methylcyclopropyl]thieno[2,3-d]pyrimidine-2,4-dione
CID 134384965
3-(3-hydroxypropyl)-1,5-dimethyl-6-[3-(trifluoromethoxy)phenyl]thieno[2,3-d]pyrimidine-2,4-dione
CID 118863150
6-bromo-5-(bromomethyl)-3-butyl-1-methylthieno[2,3-d]pyrimidine-2,4-dione
CID 122543882
5-ethyl-1,3,6-trimethylthieno[2,3-d]pyrimidine-2,4-dione;molecular iodine
CID 157445527
[1-(2-methoxyethyl)-5-methyl-2,4-dioxo-3-propylthieno[2,3-d]pyrimidin-6-yl] hydrogen carbonate
CID 118010974
CID 159884033
CID 159884033
1,3,5-trimethyl-2,4-dioxothieno[2,3-d]pyrimidine-6-carbaldehyde
CID 20692617

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]-3-propylthieno[2,3-d]pyrimidine-2,4-dione?
The IUPAC name of 1,5-dimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]-3-propylthieno[2,3-d]pyrimidine-2,4-dione (CID 69321223) is 1,5-dimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]-3-propylthieno[2,3-d]pyrimidine-2,4-dione.
What is the SMILES notation for 1,5-dimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]-3-propylthieno[2,3-d]pyrimidine-2,4-dione?
The canonical SMILES for 1,5-dimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]-3-propylthieno[2,3-d]pyrimidine-2,4-dione is CCCn1c(=O)c2c(C)c(C3=N[C@H](C)CO3)sc2n(C)c1=O.
What is the InChIKey of 1,5-dimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]-3-propylthieno[2,3-d]pyrimidine-2,4-dione?
The InChIKey is UXKMCULOVXGNKW-MRVPVSSYSA-N. The full InChI is InChI=1S/C15H19N3O3S/c1-5-6-18-13(19)10-9(3)11(12-16-8(2)7-21-12)22-14(10)17(4)15(18)20/h8H,5-7H2,1-4H3/t8-/m1/s1.
What are the key properties of 1,5-dimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]-3-propylthieno[2,3-d]pyrimidine-2,4-dione?
1,5-dimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]-3-propylthieno[2,3-d]pyrimidine-2,4-dione has a molecular weight of 321.40 g/mol, XLogP of 1.65, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-6-[(4R)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]-3-propylthieno[2,3-d]pyrimidine-2,4-dione is sourced from PubChem (CID 69321223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).