N-{3-[(adamantan-1-yl)oxy]propyl}-3-methyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonamide
Chemical Structure Depiction of
N-{3-[(adamantan-1-yl)oxy]propyl}-3-methyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonamide
N-{3-[(adamantan-1-yl)oxy]propyl}-3-methyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonamide
Compound characteristics
| Compound ID: | 8019-3991 |
| Compound Name: | N-{3-[(adamantan-1-yl)oxy]propyl}-3-methyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonamide |
| Molecular Weight: | 447.55 |
| Molecular Formula: | C22 H29 N3 O5 S |
| Smiles: | CN1C(c2cc(ccc2NC1=O)S(NCCCOC12CC3CC(CC(C3)C2)C1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8595 |
| logD: | 3.468 |
| logSw: | -4.0227 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.378 |
| InChI Key: | OPQKQSPUCMUQEU-UHFFFAOYSA-N |