Nebdoncadjmvqe-uhfffaoysa-
TL;DR: Nebdoncadjmvqe-uhfffaoysa- (CAS 229467-29-2) is a chemical compound with molecular formula C13H12O3S and molecular weight 248.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-(3-methoxyphenyl)thiophene-2-carboxylate
Also Known As: NEBDONCADJMVQE-UHFFFAOYSA-, Methyl 5-(3-methoxyphenyl)thiophene-2-carboxylate, Methyl 5-(3-methoxyphenyl)-2-thiophenecarboxylate, 2-thiophenecarboxylic acid, 5-(3-methoxyphenyl), methyl ester, InChI=1/C13H12O3S/c1-15-10-5-3-4-9(8-10)11-6-7-12(17-11)13(14)16-2/h3-8H,1-2H3
| Molecular Formula | C13H12O3S |
|---|---|
| Molecular Weight | 248.05 g/mol |
| LogP | 3.2103 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.05072 |
| Heavy Atoms | 17 |
| Complexity | 530.96576 |
Chemical Identifiers
| CAS Number | 229467-29-2 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C2=CC=C(S2)C(=O)OC |
Product Overview
Nebdoncadjmvqe-uhfffaoysa- (CAS 229467-29-2), with molecular formula C13H12O3S and molecular weight 248.05 g/mol. IUPAC: methyl 5-(3-methoxyphenyl)thiophene-2-carboxylate.
Chemical Property Profile of Nebdoncadjmvqe-uhfffaoysa-
Property Insights of Nebdoncadjmvqe-uhfffaoysa-
The XLogP value of 3.2103 indicates that Nebdoncadjmvqe-uhfffaoysa- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Nebdoncadjmvqe-uhfffaoysa- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nebdoncadjmvqe-uhfffaoysa- has 0 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 Nebdoncadjmvqe-uhfffaoysa-?
The CAS number of Nebdoncadjmvqe-uhfffaoysa- is 229467-29-2.
What is the molecular formula of Nebdoncadjmvqe-uhfffaoysa-?
The molecular formula of Nebdoncadjmvqe-uhfffaoysa- is C13H12O3S.
What is the molecular weight of Nebdoncadjmvqe-uhfffaoysa-?
The molecular weight of Nebdoncadjmvqe-uhfffaoysa- is 248.05 g/mol.
Where can I buy Nebdoncadjmvqe-uhfffaoysa-?
You can request a quote for Nebdoncadjmvqe-uhfffaoysa- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nebdoncadjmvqe-uhfffaoysa-?
Yes, KEHONG BIO provides custom synthesis services for Nebdoncadjmvqe-uhfffaoysa- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.