AB00093438-01
TL;DR: AB00093438-01 (CAS 351341-83-8) is a chemical compound with molecular formula C25H27N3O2S2 and molecular weight 465.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-benzyl-2-(benzylcarbamothioylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
Also Known As: AB00093438-01, ethyl 6-benzyl-2-(3-benzylthioureido)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate, ethyl 6-benzyl-2-(benzylcarbamothioylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate, ethyl 6-benzyl-2-[(benzylcarbamothioyl)amino]-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate, ETHYL 6-BENZYL-2-{[(BENZYLAMINO)CARBOTHIOYL]AMINO}-4,5,6,7-TETRAHYDROTHIENO[2,3-C]PYRIDINE-3-CARBOXYLATE
| Molecular Formula | C25H27N3O2S2 |
|---|---|
| Molecular Weight | 465.15 g/mol |
| LogP | 4.9697 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 465.15448 |
| Heavy Atoms | 32 |
| Complexity | 1067.5509 |
Chemical Identifiers
| CAS Number | 351341-83-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCN(C2)CC3=CC=CC=C3)NC(=S)NCC4=CC=CC=C4 |
Product Overview
AB00093438-01 (CAS 351341-83-8), with molecular formula C25H27N3O2S2 and molecular weight 465.15 g/mol. IUPAC: ethyl 6-benzyl-2-(benzylcarbamothioylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate.
Chemical Property Profile of AB00093438-01
Property Insights of AB00093438-01
The XLogP value of 4.9697 indicates that AB00093438-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.6 Ų, AB00093438-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00093438-01 has 2 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 AB00093438-01?
The CAS number of AB00093438-01 is 351341-83-8.
What is the molecular formula of AB00093438-01?
The molecular formula of AB00093438-01 is C25H27N3O2S2.
What is the molecular weight of AB00093438-01?
The molecular weight of AB00093438-01 is 465.15 g/mol.
Where can I buy AB00093438-01?
You can request a quote for AB00093438-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00093438-01?
Yes, KEHONG BIO provides custom synthesis services for AB00093438-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.