11-(4-hydroxy-3-methoxyphenyl)-10-pentanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Chemical Structure Depiction of
11-(4-hydroxy-3-methoxyphenyl)-10-pentanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
11-(4-hydroxy-3-methoxyphenyl)-10-pentanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Compound characteristics
| Compound ID: | 3805-1386 |
| Compound Name: | 11-(4-hydroxy-3-methoxyphenyl)-10-pentanoyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one |
| Molecular Weight: | 420.51 |
| Molecular Formula: | C25 H28 N2 O4 |
| Smiles: | CCCCC(N1C(C2=C(CCCC2=O)Nc2ccccc12)c1ccc(c(c1)OC)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1227 |
| logD: | 4.0144 |
| logSw: | -4.007 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.087 |
| InChI Key: | HGBFJOOKUVMDBN-VWLOTQADSA-N |