BIM-0028137.P001
TL;DR: BIM-0028137.P001 (CAS 102609-56-3) is a chemical compound with molecular formula C24H25N3O2S2 and molecular weight 451.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-benzyl-2-(phenylcarbamothioylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
Also Known As: BIM-0028137.P001, AB00093398-01, ethyl 6-benzyl-2-(phenylcarbamothioylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate, ethyl 6-benzyl-2-[(phenylcarbamothioyl)amino]-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate, ethyl 6-benzyl-2-(3-phenylthioureido)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
| Molecular Formula | C24H25N3O2S2 |
|---|---|
| Molecular Weight | 451.14 g/mol |
| LogP | 5.292 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 451.13882 |
| Heavy Atoms | 31 |
| Complexity | 1051.4462 |
Chemical Identifiers
| CAS Number | 102609-56-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCN(C2)CC3=CC=CC=C3)NC(=S)NC4=CC=CC=C4 |
Product Overview
BIM-0028137.P001 (CAS 102609-56-3), with molecular formula C24H25N3O2S2 and molecular weight 451.14 g/mol. IUPAC: ethyl 6-benzyl-2-(phenylcarbamothioylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate.
Chemical Property Profile of BIM-0028137.P001
Property Insights of BIM-0028137.P001
The XLogP value of 5.292 indicates that BIM-0028137.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.6 Ų, BIM-0028137.P001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BIM-0028137.P001 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0028137.P001?
The CAS number of BIM-0028137.P001 is 102609-56-3.
What is the molecular formula of BIM-0028137.P001?
The molecular formula of BIM-0028137.P001 is C24H25N3O2S2.
What is the molecular weight of BIM-0028137.P001?
The molecular weight of BIM-0028137.P001 is 451.14 g/mol.
Where can I buy BIM-0028137.P001?
You can request a quote for BIM-0028137.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0028137.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0028137.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.