methyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-7-ethyl-5-(4-nitrophenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-7-ethyl-5-(4-nitrophenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-7-ethyl-5-(4-nitrophenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V019-8299 |
| Compound Name: | methyl 3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-7-ethyl-5-(4-nitrophenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 513.57 |
| Molecular Formula: | C24 H27 N5 O6 S |
| Smiles: | CCC1=C(C(c2ccc(cc2)[N+]([O-])=O)N2C(CC(N3CCN(CC3)C(C)=O)=O)=CSC2=N1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2954 |
| logD: | 2.2939 |
| logSw: | -2.4521 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 100.135 |
| InChI Key: | AWMZSOGQLIKROX-JOCHJYFZSA-N |