4-(4-methoxyphenyl)-8-(4-methyl-3-nitrobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-3-one
Chemical Structure Depiction of
4-(4-methoxyphenyl)-8-(4-methyl-3-nitrobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-3-one
4-(4-methoxyphenyl)-8-(4-methyl-3-nitrobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-3-one
Compound characteristics
| Compound ID: | V029-1102 |
| Compound Name: | 4-(4-methoxyphenyl)-8-(4-methyl-3-nitrobenzoyl)-1-thia-4,8-diazaspiro[4.5]decan-3-one |
| Molecular Weight: | 441.5 |
| Molecular Formula: | C22 H23 N3 O5 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1[N+]([O-])=O)C(N1CCC2(CC1)N(C(CS2)=O)c1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.825 |
| logD: | 2.825 |
| logSw: | -3.451 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.192 |
| InChI Key: | XQNYLHUGVIYOOX-UHFFFAOYSA-N |