KST-1B0980
TL;DR: KST-1B0980 (CAS 17372-78-0) is a chemical compound with molecular formula C44H42N8O6 and molecular weight 778.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[[(2S,3S,4R,5S)-3,4-dihydroxy-5-[[2-[(5-methylpyrazine-2-carbonyl)amino]benzoyl]amino]-1,6-diphenylhexan-2-yl]carbamoyl]phenyl]-5-methylpyrazine-2-carboxamide
Also Known As: KST-1B0980, L-Altritol, 1,2,5,6-tetradeoxy-2,5-bis((2-(((5-methylpyrazinyl)carbonyl)amino)benzoyl)amino)-1,6-diphenyl-, 1,2,5,6-tetradeoxy-2,5-bis{[(2-{[(5-methylpyrazin-2-yl)carbonyl]amino}phenyl)carbonyl]amino}-1,6-diphenyl-l-altritol, 1,2,5,6-Tetradeoxy-2,5-bis[2-(5-methylpyrazine-2-carboxamido)benzamido]-1,6-diphenyl-L-altritol, L-Altritol, 1,2,5,6-tetradeoxy-2,5-bis[[2-[[(5-methylpyrazinyl)carbonyl]amino]benzoyl]amino]-1,6-diphenyl-
| Molecular Formula | C44H42N8O6 |
|---|---|
| Molecular Weight | 778.32 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 208.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 15 |
| Exact Mass | 778.32275 |
| Heavy Atoms | 58 |
| Complexity | 1230.0 |
Chemical Identifiers
| CAS Number | 17372-78-0 |
|---|---|
| SMILES | CC1=CN=C(C=N1)C(=O)NC2=CC=CC=C2C(=O)N[C@@H](CC3=CC=CC=C3)[C@H]([C@H]([C@H](CC4=CC=CC=C4)NC(=O)C5=CC=CC=C5NC(=O)C6=NC=C(N=C6)C)O)O |
| InChIKey | BZVAZLQLOKJYHQ-DXPXTPKUSA-N |
Product Overview
KST-1B0980 (CAS 17372-78-0), with molecular formula C44H42N8O6 and molecular weight 778.32 g/mol. IUPAC: N-[2-[[(2S,3S,4R,5S)-3,4-dihydroxy-5-[[2-[(5-methylpyrazine-2-carbonyl)amino]benzoyl]amino]-1,6-diphenylhexan-2-yl]carbamoyl]phenyl]-5-methylpyrazine-2-carboxamide.
Chemical Property Profile of KST-1B0980
Property Insights of KST-1B0980
The XLogP value of 4.9 indicates that KST-1B0980 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 208.0 Ų indicates high polarity, suggesting KST-1B0980 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, KST-1B0980 has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of KST-1B0980?
The CAS number of KST-1B0980 is 17372-78-0.
What is the molecular formula of KST-1B0980?
The molecular formula of KST-1B0980 is C44H42N8O6.
What is the molecular weight of KST-1B0980?
The molecular weight of KST-1B0980 is 778.32 g/mol.
Where can I buy KST-1B0980?
You can request a quote for KST-1B0980 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1B0980?
Yes, KEHONG BIO provides custom synthesis services for KST-1B0980 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.