AB01303005-01
TL;DR: AB01303005-01 (CAS 444939-87-1) is a chemical compound with molecular formula C21H21NO5S and molecular weight 399.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 4-(4-methoxyphenyl)-2-[(2-methylfuran-3-carbonyl)amino]thiophene-3-carboxylate
Also Known As: AB01303005-01, Propyl 4-(4-methoxyphenyl)-2-[(2-methylfuran-3-carbonyl)amino]thiophene-3-carboxylate, PROPYL 4-(4-METHOXYPHENYL)-2-(2-METHYLFURAN-3-AMIDO)THIOPHENE-3-CARBOXYLATE, propyl 4-(4-methoxyphenyl)-2-[(2-methyl(3-furyl))carbonylamino]thiophene-3-car boxylate, propyl 4-(4-methoxyphenyl)-2-{[(2-methylfuran-3-yl)carbonyl]amino}thiophene-3-carboxylate
| Molecular Formula | C21H21NO5S |
|---|---|
| Molecular Weight | 399.11 g/mol |
| LogP | 5.14422 |
| Topological Polar Surface Area | 77.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 399.11404 |
| Heavy Atoms | 28 |
| Complexity | 971.10486 |
Chemical Identifiers
| CAS Number | 444939-87-1 |
|---|---|
| SMILES | CCCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OC)NC(=O)C3=C(OC=C3)C |
Product Overview
AB01303005-01 (CAS 444939-87-1), with molecular formula C21H21NO5S and molecular weight 399.11 g/mol. IUPAC: propyl 4-(4-methoxyphenyl)-2-[(2-methylfuran-3-carbonyl)amino]thiophene-3-carboxylate.
Chemical Property Profile of AB01303005-01
Property Insights of AB01303005-01
The XLogP value of 5.14422 indicates that AB01303005-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.77 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01303005-01. Following Lipinski's Rule of Five, AB01303005-01 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB01303005-01?
The CAS number of AB01303005-01 is 444939-87-1.
What is the molecular formula of AB01303005-01?
The molecular formula of AB01303005-01 is C21H21NO5S.
What is the molecular weight of AB01303005-01?
The molecular weight of AB01303005-01 is 399.11 g/mol.
Where can I buy AB01303005-01?
You can request a quote for AB01303005-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01303005-01?
Yes, KEHONG BIO provides custom synthesis services for AB01303005-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.