VU0494397-1
TL;DR: VU0494397-1 (CAS 865614-94-4) is a chemical compound with molecular formula C20H27N3O3 and molecular weight 357.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[(2,6-diethylphenyl)carbamoylamino]-2,4-dimethyl-1H-pyrrole-3-carboxylate
Also Known As: VU0494397-1, F1583-0014, ethyl 5-{[(2,6-diethylphenyl)carbamoyl]amino}-2,4-dimethyl-1H-pyrrole-3-carboxylate, ethyl 5-(3-(2,6-diethylphenyl)ureido)-2,4-dimethyl-1H-pyrrole-3-carboxylate, ethyl 5-[(2,6-diethylphenyl)carbamoylamino]-2,4-dimethyl-1H-pyrrole-3-carboxylate
| Molecular Formula | C20H27N3O3 |
|---|---|
| Molecular Weight | 357.21 g/mol |
| LogP | 4.57704 |
| Topological Polar Surface Area | 83.22 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 357.20523 |
| Heavy Atoms | 26 |
| Complexity | 786.623 |
Chemical Identifiers
| CAS Number | 865614-94-4 |
|---|---|
| SMILES | CCC1=C(C(=CC=C1)CC)NC(=O)NC2=C(C(=C(N2)C)C(=O)OCC)C |
Product Overview
VU0494397-1 (CAS 865614-94-4), with molecular formula C20H27N3O3 and molecular weight 357.21 g/mol. IUPAC: ethyl 5-[(2,6-diethylphenyl)carbamoylamino]-2,4-dimethyl-1H-pyrrole-3-carboxylate.
Chemical Property Profile of VU0494397-1
Property Insights of VU0494397-1
The XLogP value of 4.57704 indicates that VU0494397-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.22 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0494397-1. Following Lipinski's Rule of Five, VU0494397-1 has 3 hydrogen bond donor(s) and 3 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 VU0494397-1?
The CAS number of VU0494397-1 is 865614-94-4.
What is the molecular formula of VU0494397-1?
The molecular formula of VU0494397-1 is C20H27N3O3.
What is the molecular weight of VU0494397-1?
The molecular weight of VU0494397-1 is 357.21 g/mol.
Where can I buy VU0494397-1?
You can request a quote for VU0494397-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0494397-1?
Yes, KEHONG BIO provides custom synthesis services for VU0494397-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.