RefChem:1073412
TL;DR: RefChem:1073412 (CAS 34144-39-3) is a chemical compound with molecular formula C19H21N3O2 and molecular weight 323.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-ylideneamino] N-tert-butylcarbamate
Also Known As: 5H-Benzo(4,5)cyclohepta(1,2-b)pyridin-5-one, 10,11-dihydro-, O-(tert-butylcarbamoyl)oxime, 10,11-Dihydro-5H-benzo(4,5)cyclohepta(1,2-b)pyridin-5-one O-(tert-butylcarbamoyl)oxime, RefChem:1073412
| Molecular Formula | C19H21N3O2 |
|---|---|
| Molecular Weight | 323.16 g/mol |
| LogP | 3.4573 |
| Topological Polar Surface Area | 63.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 323.1634 |
| Heavy Atoms | 24 |
| Complexity | 741.6941 |
Chemical Identifiers
| CAS Number | 34144-39-3 |
|---|---|
| SMILES | CC(C)(C)NC(=O)O/N=C\1/C2=C(CCC3=CC=CC=C31)N=CC=C2 |
Product Overview
RefChem:1073412 (CAS 34144-39-3), with molecular formula C19H21N3O2 and molecular weight 323.16 g/mol. IUPAC: [(E)-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-ylideneamino] N-tert-butylcarbamate.
Chemical Property Profile of RefChem:1073412
Property Insights of RefChem:1073412
The XLogP value of 3.4573 indicates that RefChem:1073412 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.58 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1073412. Following Lipinski's Rule of Five, RefChem:1073412 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1073412?
The CAS number of RefChem:1073412 is 34144-39-3.
What is the molecular formula of RefChem:1073412?
The molecular formula of RefChem:1073412 is C19H21N3O2.
What is the molecular weight of RefChem:1073412?
The molecular weight of RefChem:1073412 is 323.16 g/mol.
Where can I buy RefChem:1073412?
You can request a quote for RefChem:1073412 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1073412?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1073412 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.