(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)(2-methyl-11-propyldibenzo[b,f][1,4]thiazepin-8-yl)methanone
Chemical Structure Depiction of
(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)(2-methyl-11-propyldibenzo[b,f][1,4]thiazepin-8-yl)methanone
(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)(2-methyl-11-propyldibenzo[b,f][1,4]thiazepin-8-yl)methanone
Compound characteristics
| Compound ID: | C304-1421 |
| Compound Name: | (1,4-dioxa-8-azaspiro[4.5]decan-8-yl)(2-methyl-11-propyldibenzo[b,f][1,4]thiazepin-8-yl)methanone |
| Molecular Weight: | 436.57 |
| Molecular Formula: | C25 H28 N2 O3 S |
| Smiles: | CCCC1c2cc(C)ccc2Sc2ccc(cc2N=1)C(N1CCC2(CC1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.519 |
| logD: | 4.5179 |
| logSw: | -4.2726 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.316 |
| InChI Key: | KGTOAONOHITLGO-UHFFFAOYSA-N |