Basic Information
| Drug ID | DDPD00475 |
|
| Drug Name | Chlordiazepoxide | |
| Molecular Weight | 299.755 | |
| Molecular Formula | C16H14ClN3O | |
| CAS Number | 58-25-3 | |
| SMILES | CNC1=NC2=C(C=C(Cl)C=C2)C(C2=CC=CC=C2)=[N+]([O-])C1 | |
| External Links | ||
| DRUGBANK | DB00475 | |
| T3DB | T3D2804 | |
| PubChem Compound | 2712 | |
| Drugs.com | Drugs.com Drug Page | |
Experimental Physicochemical Property
| Property Name | Property Value | Unit | Raw Value | Raw Unit | Reference |
|---|---|---|---|---|---|
| Log P | 2.44 | - | 2.44 | - | HANSCH,C ET AL. (1995) |
| Melting Point | 236.25 | ℃ | 236-236.5 | ℃ | Sternbach, L.H.; US. Patent 2,893,992; July 7,1959; assigned to Hoffmann-LaRoche, Inc. |
| Water Solubility | 2000.0 | mg/L | 2000 | mg/L | YALKOWSKY,SH & DANNENFELSER,RM 1992) |
| pKa | 4.8 | - | 4.8 | - | MERCK INDEX (1996) |
Pharmacokinetic/ Toxicokinetic Property
| Property Name | Property Value | Unit | Raw Value | Raw Unit | Annotation | Reference |
|---|---|---|---|---|---|---|
| Clearance | 0.0222 | L/h/kg | 0.37 | ml/min/kg | intravenous injection, IV; human, homo sapiens; | Human Intravenous Pharmacokinetic Dataset |
| Volume of Distribution | 0.25 | L/kg | 0.25 | L/kg | intravenous injection, IV; human, homo sapiens; | Human Intravenous Pharmacokinetic Dataset |
| Half-life | 36.0 | h | 24-48 | h | DRUGBANK | Half-life | 8.3 | h | 8.3 | h | intravenous injection, IV; human, homo sapiens; | Human Intravenous Pharmacokinetic Dataset |
| Toxicity LD50 | 537.0 | mg/kg | 537.0 | mg/kg | PO, oral; Rattus, Rat; | DRUGBANK | Toxicity LD50 | 537.0 | mg/kg | 537.0 | mg/kg | PO, oral; Rattus, Rat; | T3DB |
| Eliminate Route | 1.5 | % | 1-2 | % | Urinary excretion; Unchanged drug; | DRUGBANK |
Maximum Dosage
Not Available
Drug Property Radar Chart
Note: Center: Q1-1.5*IQR, Edge: Q3+1.5*IQR; Q1: Quantile 1, Q3: Quantile 3, IQR: Q3-Q1