4-benzylisoquinoline
From DrugPedia: A Wikipedia for Drug discovery
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 | ? |
[edit] Description
[edit] 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