benzyl 7-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-5-(thiophen-2-yl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
benzyl 7-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-5-(thiophen-2-yl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
benzyl 7-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-5-(thiophen-2-yl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V025-2674 |
| Compound Name: | benzyl 7-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-5-(thiophen-2-yl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 508.66 |
| Molecular Formula: | C26 H28 N4 O3 S2 |
| Salt: | not_available |
| Smiles: | CC1=C(C(c2cccs2)N2C(CC(N3CCN(C)CC3)=O)=CSC2=N1)C(=O)OCc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2161 |
| logD: | 2.99 |
| logSw: | -3.1922 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.13 |
| InChI Key: | BTDQBUUHFJKXHX-XMMPIXPASA-N |