3-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethyl]-6-[1-(2-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
3-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethyl]-6-[1-(2-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
3-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethyl]-6-[1-(2-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | V003-2266 |
| Compound Name: | 3-[2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-2-oxoethyl]-6-[1-(2-fluorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 523.59 |
| Molecular Formula: | C26 H26 F N5 O4 S |
| Smiles: | CC1=C(C(N2C(CC(N3CCC4(CC3)OCCO4)=O)=CSC2=N1)=O)c1cc(C)n(c2ccccc2F)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.0442 |
| logD: | 2.0442 |
| logSw: | -2.4498 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.181 |
| InChI Key: | WBUPITZHJPDNDM-UHFFFAOYSA-N |