Basic information
- CAS
199852-37-4- Standard SMILES
COC1CSc2nc(Cc3ccccc3)c(C(C)C)c(=O)n21- InChIKey
PACQPJPTAVHWMH-UHFFFAOYSA-N- Molecular formula
- C17H20N2O2S
- Average molar mass
- 316.4 g/mol
- Monoisotopic mass
- 316.12454906
Names & identifiers
- Preferred name
- 5H-Thiazolo(3,2-a)pyrimidin-5-one, 2,3-dihydro-3-methoxy-6-(1-methylethyl)-7-(phenylmethyl)-
- IUPAC
- 7-benzyl-3-methoxy-6-propan-2-yl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Names & synonyms
199852-37-45H-Thiazolo(3,2-a)pyrimidin-5-one, 2,3-dihydro-3-methoxy-6-(1-methylethyl)-7-(phenylmethyl)-5H-Thiazolo[3,2-a]pyrimidin-5-one, 2,3-dihydro-3-methoxy-6-(1-methylethyl)-7-(phenylmethyl)-DTXSID009419497-benzyl-6-isopropyl-3-methoxy-2,3-dihydrothiazolo[3,2-a]pyrimidin-5-one7-Benzyl-3-methoxy-6-(propan-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Database identifiers
- CAS
199852-37-4- PubChem CID
- 456301
- DTXSID
DTXSID00941949- Nikkaji
- J915.073K
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 67.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 507
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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