prop-2-en-1-yl 7-(4-chlorophenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
prop-2-en-1-yl 7-(4-chlorophenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate
prop-2-en-1-yl 7-(4-chlorophenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | K832-4186 |
| Compound Name: | prop-2-en-1-yl 7-(4-chlorophenyl)-5-methyl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 331.76 |
| Molecular Formula: | C15 H14 Cl N5 O2 |
| Smiles: | CC1=C(C(c2ccc(cc2)[Cl])n2c(N1)nnn2)C(=O)OCC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6886 |
| logD: | 1.9522 |
| logSw: | -3.7643 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.515 |
| InChI Key: | XNBNJSDHTDVESP-ZDUSSCGKSA-N |