Synonym: (4R)-rel-3,5-Pyridinedicarboxylic acid; 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-; 3-methyl 5-[(3R)-1-(phenylmethyl)-3-piperidinyl] ester; KW-3049; hydrochloride (1:1)
CAS Number: 91599-74-5
Empirical Formula (Hill Notation): C28H31N3O6·HCl
Molecular Weight: 542.02
MDL Number: MFCD00906929
Linear Formula: C28H31N3O6·HCl
Product Type: Chemical
| assay |
≥98% (HPLC) |
| color |
yellow |
| form |
powder |
| InChI |
1S/C28H31N3O6.ClH/c1-18-24(27(32)36-3)26(21-11-7-12-22(15-21)31(34)35)25(19(2)29-18)28(33)37-23-13-8-14-30(17-23)16-20-9-5-4-6-10-20;/h4-7,9-12,15,23,26,29H,8,13-14,16-17H2,1-3H3;1H/t23-,26-;/m1./s1 |
| InChI key |
KILKDKRQBYMKQX-MIPPOABVSA-N |
| Quality Level |
100  |
| SMILES string |
Cl.COC(=O)C1=C(C)NC(C)=C([C@@H]1c2cccc(c2)[N+]([O-])=O)C(=O)O[C@@H]3CCCN(C3)Cc4ccccc4 |
| solubility |
DMSO: ≥20 mg/mL |
| storage condition |
desiccated |
| storage temp. |
2-8°C |
| Biochem/physiol Actions: |
Calcium Channel Blocker |
| Features and Benefits: |
This compound is featured on the Calcium Channels page of the Handbook of Receptor Classification and Signal Transduction. To browse other handbook pages, click here . |
| Packaging: |
10, 50 mg in glass bottle |
| Symbol |
 GHS06 |
| Signal word |
Danger |
| Hazard statements |
H301 |
| Precautionary statements |
P301 + P310 |
| Hazard Codes |
T |
| Risk Statements |
25 |
| Safety Statements |
45 |
| RIDADR |
UN 2811 6.1 / PGIII |
| WGK Germany |
WGK 3 |
| Flash Point(F) |
Not applicable |
| Flash Point(C) |
Not applicable |
| Purity |
≥98% (HPLC) |
| Storage Temp. |
2-8°C |
| UNSPSC |
12352200 |
