D-3017
TL;DR: D-3017 (CAS 130403-18-8) is a chemical compound with molecular formula C13H14N2O3 and molecular weight 246.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,6-dimethylphenyl)-5-(hydroxymethyl)-1,2-oxazole-3-carboxamide
Also Known As: 3-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-5-(hydroxymethyl)-, N-(2,6-Dimethylphenyl)-5-(hydroxymethyl)-3-isoxazolecarboxamide, N-(2,6-dimethylphenyl)-5-(hydroxymethyl)-1,2-oxazole-3-carboxamide, 5-(Hydroxymethyl)-N-(2,6-dimethylphenyl)isoxazole-3-carboxamide, BRN 5853002
| Molecular Formula | C13H14N2O3 |
|---|---|
| Molecular Weight | 246.10 g/mol |
| LogP | 2.03604 |
| Topological Polar Surface Area | 75.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 246.10045 |
| Heavy Atoms | 18 |
| Complexity | 555.11536 |
Chemical Identifiers
| CAS Number | 130403-18-8 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC(=O)C2=NOC(=C2)CO |
Product Overview
D-3017 (CAS 130403-18-8), with molecular formula C13H14N2O3 and molecular weight 246.10 g/mol. IUPAC: N-(2,6-dimethylphenyl)-5-(hydroxymethyl)-1,2-oxazole-3-carboxamide.
Chemical Property Profile of D-3017
Property Insights of D-3017
The XLogP value of 2.03604 suggests moderate lipophilicity, balancing water solubility and membrane permeability for D-3017. The TPSA of 75.36 Ų falls within the moderate polarity range, balancing permeability and solubility for D-3017. Following Lipinski's Rule of Five, D-3017 has 2 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 D-3017?
The CAS number of D-3017 is 130403-18-8.
What is the molecular formula of D-3017?
The molecular formula of D-3017 is C13H14N2O3.
What is the molecular weight of D-3017?
The molecular weight of D-3017 is 246.10 g/mol.
Where can I buy D-3017?
You can request a quote for D-3017 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D-3017?
Yes, KEHONG BIO provides custom synthesis services for D-3017 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.