N-cyclopropyl-1-{6-[2-(2,5-difluoroanilino)-2-oxoethyl]-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl}piperidine-4-carboxamide
Chemical Structure Depiction of
N-cyclopropyl-1-{6-[2-(2,5-difluoroanilino)-2-oxoethyl]-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl}piperidine-4-carboxamide
N-cyclopropyl-1-{6-[2-(2,5-difluoroanilino)-2-oxoethyl]-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl}piperidine-4-carboxamide
Compound characteristics
Compound ID: | L865-2837 |
Compound Name: | N-cyclopropyl-1-{6-[2-(2,5-difluoroanilino)-2-oxoethyl]-7-oxo-6,7-dihydro[1,3]thiazolo[4,5-d]pyrimidin-2-yl}piperidine-4-carboxamide |
Molecular Weight: | 488.51 |
Molecular Formula: | C22 H22 F2 N6 O3 S |
Smiles: | C1CN(CCC1C(NC1CC1)=O)c1nc2c(C(N(CC(Nc3cc(ccc3F)F)=O)C=N2)=O)s1 |
Stereo: | ACHIRAL |
logP: | 2.3223 |
logD: | 2.3146 |
logSw: | -2.9224 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 87.109 |
InChI Key: | LCRUHZJXVHTLDZ-UHFFFAOYSA-N |