K408-0487
TL;DR: K408-0487 (CAS 449768-01-8) is a chemical compound with molecular formula C25H33N3O5S2 and molecular weight 519.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[4-(2-methylpiperidin-1-yl)sulfonylbenzoyl]amino]-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
Also Known As: K408-0487, F0539-0905, methyl 2-{4-[(2-methylpiperidin-1-yl)sulfonyl]benzamido}-6-(propan-2-yl)-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate, methyl 2-[[4-(2-methylpiperidin-1-yl)sulfonylbenzoyl]amino]-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate, methyl 6-isopropyl-2-(4-((2-methylpiperidin-1-yl)sulfonyl)benzamido)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
| Molecular Formula | C25H33N3O5S2 |
|---|---|
| Molecular Weight | 519.19 g/mol |
| LogP | 4.1166 |
| Topological Polar Surface Area | 96.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 519.18616 |
| Heavy Atoms | 35 |
| Complexity | 1204.4357 |
Chemical Identifiers
| CAS Number | 449768-01-8 |
|---|---|
| SMILES | CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=C(C4=C(S3)CN(CC4)C(C)C)C(=O)OC |
Product Overview
K408-0487 (CAS 449768-01-8), with molecular formula C25H33N3O5S2 and molecular weight 519.19 g/mol. IUPAC: methyl 2-[[4-(2-methylpiperidin-1-yl)sulfonylbenzoyl]amino]-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate.
Chemical Property Profile of K408-0487
Property Insights of K408-0487
The XLogP value of 4.1166 indicates that K408-0487 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.02 Ų falls within the moderate polarity range, balancing permeability and solubility for K408-0487. Following Lipinski's Rule of Five, K408-0487 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of K408-0487?
The CAS number of K408-0487 is 449768-01-8.
What is the molecular formula of K408-0487?
The molecular formula of K408-0487 is C25H33N3O5S2.
What is the molecular weight of K408-0487?
The molecular weight of K408-0487 is 519.19 g/mol.
Where can I buy K408-0487?
You can request a quote for K408-0487 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for K408-0487?
Yes, KEHONG BIO provides custom synthesis services for K408-0487 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.