methyl 4-{[4-(cyclopropylmethyl)-1,3-dioxo-1lambda~4~-thia-4,8-diazaspiro[4.5]decane-8-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 4-{[4-(cyclopropylmethyl)-1,3-dioxo-1lambda~4~-thia-4,8-diazaspiro[4.5]decane-8-carbonyl]amino}benzoate
methyl 4-{[4-(cyclopropylmethyl)-1,3-dioxo-1lambda~4~-thia-4,8-diazaspiro[4.5]decane-8-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | S588-0462 |
| Compound Name: | methyl 4-{[4-(cyclopropylmethyl)-1,3-dioxo-1lambda~4~-thia-4,8-diazaspiro[4.5]decane-8-carbonyl]amino}benzoate |
| Molecular Weight: | 419.5 |
| Molecular Formula: | C20 H25 N3 O5 S |
| Smiles: | COC(c1ccc(cc1)NC(N1CCC2(CC1)N(CC1CC1)C(CS2=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7883 |
| logD: | 1.7883 |
| logSw: | -2.4476 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.827 |
| InChI Key: | ZYTIFXXVPVPILT-UHFFFAOYSA-N |