ethyl [5-(N,N-diethyl-beta-alanyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl]carbamate
Chemical Structure Depiction of
ethyl [5-(N,N-diethyl-beta-alanyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl]carbamate
ethyl [5-(N,N-diethyl-beta-alanyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl]carbamate
Compound characteristics
| Compound ID: | S008-0030 |
| Compound Name: | ethyl [5-(N,N-diethyl-beta-alanyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl]carbamate |
| Molecular Weight: | 409.53 |
| Molecular Formula: | C24 H31 N3 O3 |
| Smiles: | CCN(CC)CCC(N1c2ccccc2CCc2ccc(cc12)NC(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7255 |
| logD: | 4.1427 |
| logSw: | -4.2044 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.8 |
| InChI Key: | AFIYKNJKFJVVGS-UHFFFAOYSA-N |