ethyl [5-(N,N-dimethyl-beta-alanyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl]carbamate
Chemical Structure Depiction of
ethyl [5-(N,N-dimethyl-beta-alanyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl]carbamate
ethyl [5-(N,N-dimethyl-beta-alanyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl]carbamate
Compound characteristics
| Compound ID: | 4119-0052 |
| Compound Name: | ethyl [5-(N,N-dimethyl-beta-alanyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl]carbamate |
| Molecular Weight: | 381.47 |
| Molecular Formula: | C22 H27 N3 O3 |
| Smiles: | CCOC(Nc1ccc2CCc3ccccc3N(C(CCN(C)C)=O)c2c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9545 |
| logD: | 3.5758 |
| logSw: | -3.869 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.254 |
| InChI Key: | QWZNTHPYWMQGTC-UHFFFAOYSA-N |