Tmc-95A
TL;DR: Tmc-95A (CAS 220666-21-7) is a chemical compound with molecular formula C33H38N6O10 and molecular weight 678.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(10S,11R,12S,15S,18S)-15-(2-amino-2-oxoethyl)-10,11,23-trihydroxy-18-[[(3S)-3-methyl-2-oxopentanoyl]amino]-9,14,17-trioxo-N-[(Z)-prop-1-enyl]-8,13,16-triazatetracyclo[18.3.1.02,7.06,10]tetracosa-1(23),2(7),3,5,20(24),21-hexaene-12-carboxamide
Also Known As: TMC-95A, TMC 95A, TMC-95 A, J1.280.266H, (10S,11R,12S,15S,18S)-15-(2-amino-2-oxoethyl)-10,11,23-trihydroxy-18-(((3S)-3-methyl-2-oxopentanoyl)amino)-9,14,17-trioxo-N-((Z)-prop-1-enyl)-8,13,16-triazatetracyclo(18.3.1.02,7.06,10)tetracosa-1(23),2(7),3,5,20(24),21-hexaene-12-carboxamide
| Molecular Formula | C33H38N6O10 |
|---|---|
| Molecular Weight | 678.26 g/mol |
| LogP | -1.2893 |
| Topological Polar Surface Area | 266.35 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 678.26495 |
| Heavy Atoms | 49 |
| Complexity | 1742.0345 |
Chemical Identifiers
| CAS Number | 220666-21-7 |
|---|---|
| SMILES | CC[C@H](C)C(=O)C(=O)N[C@H]1CC2=CC(=C(C=C2)O)C3=C4C(=CC=C3)[C@]([C@@H]([C@H](NC(=O)[C@@H](NC1=O)CC(=O)N)C(=O)N/C=C\C)O)(C(=O)N4)O |
Product Overview
Tmc-95A (CAS 220666-21-7), with molecular formula C33H38N6O10 and molecular weight 678.26 g/mol. IUPAC: (10S,11R,12S,15S,18S)-15-(2-amino-2-oxoethyl)-10,11,23-trihydroxy-18-[[(3S)-3-methyl-2-oxopentanoyl]amino]-9,14,17-trioxo-N-[(Z)-prop-1-enyl]-8,13,16-triazatetracyclo[18.3.1.02,7.06,10]tetracosa-1(23),2(7),3,5,20(24),21-hexaene-12-carboxamide.
Chemical Property Profile of Tmc-95A
Property Insights of Tmc-95A
The XLogP value of -1.2893 indicates that Tmc-95A is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 266.35 Ų indicates high polarity, suggesting Tmc-95A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tmc-95A has 9 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 Tmc-95A?
The CAS number of Tmc-95A is 220666-21-7.
What is the molecular formula of Tmc-95A?
The molecular formula of Tmc-95A is C33H38N6O10.
What is the molecular weight of Tmc-95A?
The molecular weight of Tmc-95A is 678.26 g/mol.
Where can I buy Tmc-95A?
You can request a quote for Tmc-95A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tmc-95A?
Yes, KEHONG BIO provides custom synthesis services for Tmc-95A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.