8-methyl-2-(pyrrolidine-1-sulfonyl)-3-(pyrrolidin-1-yl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
8-methyl-2-(pyrrolidine-1-sulfonyl)-3-(pyrrolidin-1-yl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
8-methyl-2-(pyrrolidine-1-sulfonyl)-3-(pyrrolidin-1-yl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-0906 |
| Compound Name: | 8-methyl-2-(pyrrolidine-1-sulfonyl)-3-(pyrrolidin-1-yl)dibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C22 H25 N3 O4 S |
| Smiles: | Cc1ccc2c(c1)NC(c1cc(c(cc1O2)N1CCCC1)S(N1CCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8313 |
| logD: | 3.7852 |
| logSw: | -4.0211 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.935 |
| InChI Key: | UMGAOVLTLXEEHY-UHFFFAOYSA-N |