methyl 4-{N-(2-chlorobenzoyl)-N-[2-(morpholin-4-yl)ethyl]alanyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-{N-(2-chlorobenzoyl)-N-[2-(morpholin-4-yl)ethyl]alanyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
methyl 4-{N-(2-chlorobenzoyl)-N-[2-(morpholin-4-yl)ethyl]alanyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | V005-2538 |
| Compound Name: | methyl 4-{N-(2-chlorobenzoyl)-N-[2-(morpholin-4-yl)ethyl]alanyl}-1,3,5-trimethyl-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 490 |
| Molecular Formula: | C25 H32 Cl N3 O5 |
| Salt: | not_available |
| Smiles: | CC(C(c1c(C)c(C(=O)OC)n(C)c1C)=O)N(CCN1CCOCC1)C(c1ccccc1[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3646 |
| logD: | 2.3588 |
| logSw: | -3.3867 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.132 |
| InChI Key: | HICVTUXJWXAOFA-SFHVURJKSA-N |