2-{[(3-chlorophenyl)methyl]sulfanyl}-7-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-3-[(2-methoxyphenyl)methyl]quinazolin-4(3H)-one
Chemical Structure Depiction of
2-{[(3-chlorophenyl)methyl]sulfanyl}-7-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-3-[(2-methoxyphenyl)methyl]quinazolin-4(3H)-one
2-{[(3-chlorophenyl)methyl]sulfanyl}-7-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-3-[(2-methoxyphenyl)methyl]quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | K284-2348 |
| Compound Name: | 2-{[(3-chlorophenyl)methyl]sulfanyl}-7-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-3-[(2-methoxyphenyl)methyl]quinazolin-4(3H)-one |
| Molecular Weight: | 592.11 |
| Molecular Formula: | C31 H30 Cl N3 O5 S |
| Smiles: | COc1ccccc1CN1C(=Nc2cc(ccc2C1=O)C(N1CCC2(CC1)OCCO2)=O)SCc1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.5866 |
| logD: | 4.5866 |
| logSw: | -4.6286 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.487 |
| InChI Key: | RSTKGPULGQMHJL-UHFFFAOYSA-N |