N-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide
Chemical Structure Depiction of
N-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide
N-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide
Compound characteristics
| Compound ID: | E006-0038 |
| Compound Name: | N-(10-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide |
| Molecular Weight: | 425.51 |
| Molecular Formula: | C22 H23 N3 O4 S |
| Smiles: | CN1C(c2ccccc2Sc2ccc(cc12)NC(N1CCC2(CC1)OCCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7854 |
| logD: | 2.7854 |
| logSw: | -3.6336 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.344 |
| InChI Key: | KFCKXNXZJJLSTC-UHFFFAOYSA-N |