General Information of the Compound
| Compound ID |
CP0433882
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(3S,4R)-4-(4-ethylphenylsulfonamido)-3-hydroxy-N,2,2-trimethyl-N-phenyl-3,4-dihydro-2H-chromene-6-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C27H30N2O5S
|
||||||||||||||||||
| Molecular Weight |
494.613
|
||||||||||||||||||
| Canonical SMILES |
CCc1ccc(cc1)S(=O)(=O)N[C@H]1[C@H](O)C(C)(C)Oc2ccc(cc12)C(=O)N(C)c1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C27H30N2O5S/c1-5-18-11-14-21(15-12-18)35(32,33)28-24-22-17-19(13-16-23(22)34-27(2,3)25(24)30)26(31)29(4)20-9-7-6-8-10-20/h6-17,24-25,28,30H,5H2,1-4H3/t24-,25+/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
KAUFNIJIXRJXQF-RPBOFIJWSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound