N-(1-benzylpiperidin-4-yl)-N~2~-(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonyl)methioninamide
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-N~2~-(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonyl)methioninamide
N-(1-benzylpiperidin-4-yl)-N~2~-(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonyl)methioninamide
Compound characteristics
| Compound ID: | K906-1127 |
| Compound Name: | N-(1-benzylpiperidin-4-yl)-N~2~-(1,3-dimethyl-2,4-dioxo-1,2,3,4-tetrahydroquinazoline-6-sulfonyl)methioninamide |
| Molecular Weight: | 573.73 |
| Molecular Formula: | C27 H35 N5 O5 S2 |
| Smiles: | CN1C(c2cc(ccc2N(C)C1=O)S(NC(CCSC)C(NC1CCN(CC1)Cc1ccccc1)=O)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7868 |
| logD: | 1.2291 |
| logSw: | -3.6611 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.894 |
| InChI Key: | IKEQYHAZMQTKSN-QHCPKHFHSA-N |