7-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
Chemical Structure Depiction of
7-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
7-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
Compound characteristics
| Compound ID: | E975-1588 |
| Compound Name: | 7-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-one |
| Molecular Weight: | 384.47 |
| Molecular Formula: | C16 H20 N2 O5 S2 |
| Smiles: | C1CSc2ccc(cc2NC1=O)S(N1CCC2(CC1)OCCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2983 |
| logD: | 1.298 |
| logSw: | -2.4707 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.538 |
| InChI Key: | HMTCJSVPOHPQAA-UHFFFAOYSA-N |