2-[6-amino-3-(4-butoxyphenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-4-bromophenyl morpholine-4-carboxylate
Chemical Structure Depiction of
2-[6-amino-3-(4-butoxyphenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-4-bromophenyl morpholine-4-carboxylate
2-[6-amino-3-(4-butoxyphenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-4-bromophenyl morpholine-4-carboxylate
Compound characteristics
| Compound ID: | 8012-0226 |
| Compound Name: | 2-[6-amino-3-(4-butoxyphenyl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-4-bromophenyl morpholine-4-carboxylate |
| Molecular Weight: | 594.46 |
| Molecular Formula: | C28 H28 Br N5 O5 |
| Smiles: | CCCCOc1ccc(cc1)c1c2C(C(C#N)=C(N)Oc2[nH]n1)c1cc(ccc1OC(N1CCOCC1)=O)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8448 |
| logD: | 4.8448 |
| logSw: | -4.6813 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 108.482 |
| InChI Key: | DBKJJIGZGGCDAV-QHCPKHFHSA-N |