Bionet1_002953
TL;DR: Bionet1_002953 (CAS 339018-10-9) is a chemical compound with molecular formula C13H13IN4O3 and molecular weight 400.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-iodo-2-pyridinyl)-3-(N-methoxy-C-methylcarbonimidoyl)-5-methyl-1,2-oxazole-4-carboxamide
Also Known As: Bionet1_002953, N-(5-iodo-2-pyridinyl)-3-(methoxyethanimidoyl)-5-methyl-4-isoxazolecarboxamide, N-(5-iodopyridin-2-yl)-3-(N-methoxy-C-methylcarbonimidoyl)-5-methyl-1,2-oxazole-4-carboxamide
| Molecular Formula | C13H13IN4O3 |
|---|---|
| Molecular Weight | 400.00 g/mol |
| LogP | 2.60532 |
| Topological Polar Surface Area | 89.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.00323 |
| Heavy Atoms | 21 |
| Complexity | 679.22485 |
Chemical Identifiers
| CAS Number | 339018-10-9 |
|---|---|
| SMILES | CC1=C(C(=NO1)C(=NOC)C)C(=O)NC2=NC=C(C=C2)I |
Product Overview
Bionet1_002953 (CAS 339018-10-9), with molecular formula C13H13IN4O3 and molecular weight 400.00 g/mol. IUPAC: N-(5-iodo-2-pyridinyl)-3-(N-methoxy-C-methylcarbonimidoyl)-5-methyl-1,2-oxazole-4-carboxamide.
Chemical Property Profile of Bionet1_002953
Property Insights of Bionet1_002953
The XLogP value of 2.60532 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bionet1_002953. The TPSA of 89.61 Ų falls within the moderate polarity range, balancing permeability and solubility for Bionet1_002953. Following Lipinski's Rule of Five, Bionet1_002953 has 1 hydrogen bond donor(s) and 6 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 Bionet1_002953?
The CAS number of Bionet1_002953 is 339018-10-9.
What is the molecular formula of Bionet1_002953?
The molecular formula of Bionet1_002953 is C13H13IN4O3.
What is the molecular weight of Bionet1_002953?
The molecular weight of Bionet1_002953 is 400.00 g/mol.
Where can I buy Bionet1_002953?
You can request a quote for Bionet1_002953 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bionet1_002953?
Yes, KEHONG BIO provides custom synthesis services for Bionet1_002953 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.