5'-bromo-5-butyl-7-methylspiro[1,3-diazatricyclo[3.3.1.1~3,7~]decane-2,3'-indole]-2',6(1'H)-dione
Chemical Structure Depiction of
5'-bromo-5-butyl-7-methylspiro[1,3-diazatricyclo[3.3.1.1~3,7~]decane-2,3'-indole]-2',6(1'H)-dione
5'-bromo-5-butyl-7-methylspiro[1,3-diazatricyclo[3.3.1.1~3,7~]decane-2,3'-indole]-2',6(1'H)-dione
Compound characteristics
Compound ID: | 8016-5389 |
Compound Name: | 5'-bromo-5-butyl-7-methylspiro[1,3-diazatricyclo[3.3.1.1~3,7~]decane-2,3'-indole]-2',6(1'H)-dione |
Molecular Weight: | 418.33 |
Molecular Formula: | C20 H24 Br N3 O2 |
Smiles: | CCCCC12CN3CC(C)(CN(C1)C31C(Nc3ccc(cc13)[Br])=O)C2=O |
Stereo: | ACHIRAL |
logP: | 4.3156 |
logD: | 4.2496 |
logSw: | -4.2538 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 44.029 |
InChI Key: | AZDKKXBGBBBQLC-UHFFFAOYSA-N |