starbld0036249
TL;DR: starbld0036249 (CAS 297761-75-2) is a chemical compound with molecular formula C20H30N2O3S and molecular weight 378.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[3-(azepan-1-yl)propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: starbld0036249, BAS 00311445, AH-262/08459013, ETHYL 2-[3-(AZEPAN-1-YL)PROPANAMIDO]-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE, Ethyl 2-(3-(azepan-1-yl)propanamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
| Molecular Formula | C20H30N2O3S |
|---|---|
| Molecular Weight | 378.20 g/mol |
| LogP | 4.0082 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 378.19772 |
| Heavy Atoms | 26 |
| Complexity | 633.246 |
Chemical Identifiers
| CAS Number | 297761-75-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CCN3CCCCCC3 |
Product Overview
starbld0036249 (CAS 297761-75-2), with molecular formula C20H30N2O3S and molecular weight 378.20 g/mol. IUPAC: ethyl 2-[3-(azepan-1-yl)propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of starbld0036249
Property Insights of starbld0036249
The XLogP value of 4.0082 indicates that starbld0036249 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.64 Ų, starbld0036249 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, starbld0036249 has 1 hydrogen bond donor(s) and 5 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 starbld0036249?
The CAS number of starbld0036249 is 297761-75-2.
What is the molecular formula of starbld0036249?
The molecular formula of starbld0036249 is C20H30N2O3S.
What is the molecular weight of starbld0036249?
The molecular weight of starbld0036249 is 378.20 g/mol.
Where can I buy starbld0036249?
You can request a quote for starbld0036249 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for starbld0036249?
Yes, KEHONG BIO provides custom synthesis services for starbld0036249 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.