4-benzylisoquinoline
From DrugPedia: A Wikipedia for Drug discovery
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Revision as of 11:42, 10 December 2009
| 4-benzylisoquinoline
| |
| Systematic (IUPAC) name | |
| 4-(phenylmethyl)isoquinoline | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C16H13N |
| Mol. mass | 219.28112 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
Description
General Properties
*Molecular Weight
219.28112
*Molecular Formula
C16H13N
*IUPAC NAME
4-(phenylmethyl)isoquinoline
*Canonical Smiles
C1=CC=C(C=C1)CC2=CN=CC3=CC=CC=C32
*Isomeric Smiles
N/A
*XLogP
3.8
*Topological Polar Surface Area
12.9
