微管蛋白乙酰化抑制剂
TL;DR: 微管蛋白乙酰化抑制剂 (CAS 537049-40-4) is a chemical compound with molecular formula C41H43N3O7S and molecular weight 721.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
微管蛋白乙酰化抑制剂
N-[4-[4-[(4,5-diphenyl-1,3-oxazol-2-yl)sulfanylmethyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]phenyl]-N'-hydroxyoctanediamide
Also Known As: Tubacin, J1.902.036C, N-[4-[(2R,4R,6S)-4-[[(4,5-Diphenyl-2-oxazolyl)thio]methyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]phenyl]-N'-hydroxyoctanediamide, N-[4-[4-[(4,5-diphenyl-1,3-oxazol-2-yl)sulfanylmethyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]phenyl]-N'-hydroxyoctanediamide, N -Hydroxy-N-[4-[4-(4,5-diphenyloxazole-2-ylthiomethyl)-6-(4-hydroxymethylphenyl)-1,3-dioxane-2-yl]phenyl]octanediamide
| Molecular Formula | C41H43N3O7S |
|---|---|
| Molecular Weight | 721.28 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 168.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 16 |
| Exact Mass | 721.28217 |
| Heavy Atoms | 52 |
| Complexity | 1060.0 |
Chemical Identifiers
| CAS Number | 537049-40-4 |
|---|---|
| SMILES | C1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)NC(=O)CCCCCCC(=O)NO)CSC4=NC(=C(O4)C5=CC=CC=C5)C6=CC=CC=C6 |
| InChIKey | BHUZLJOUHMBZQY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
微管蛋白乙酰化抑制剂 (CAS 537049-40-4), with molecular formula C41H43N3O7S and molecular weight 721.28 g/mol. IUPAC: N-[4-[4-[(4,5-diphenyl-1,3-oxazol-2-yl)sulfanylmethyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]phenyl]-N'-hydroxyoctanediamide.
Chemical Property Profile of 微管蛋白乙酰化抑制剂
Property Insights of 微管蛋白乙酰化抑制剂
The XLogP value of 6.3 indicates that Tubacin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 168.0 Ų indicates high polarity, suggesting 微管蛋白乙酰化抑制剂 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tubacin has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tubacin?
The CAS number of Tubacin is 537049-40-4.
What is the molecular formula of Tubacin?
The molecular formula of Tubacin is C41H43N3O7S.
What is the molecular weight of Tubacin?
The molecular weight of Tubacin is 721.28 g/mol.
Where can I buy Tubacin?
You can request a quote for Tubacin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tubacin?
Yes, KEHONG BIO provides custom synthesis services for Tubacin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.