Maytansine, 2'-de(acetylmethylamino)-22-demethyl-2'-methyl-
TL;DR: Maytansine, 2'-de(acetylmethylamino)-22-demethyl-2'-methyl- (CAS 77353-69-6) is a chemical compound with molecular formula C31H41ClN2O9 and molecular weight 620.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2R,3S,5S,6S,16E,18E,20R,21S)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,16-trimethyl-8,23-dioxo-4,24-dioxa-9,22-diazatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl] 2-methylpropanoate
Also Known As: Ansamitocin pdm-3, N-Demethylansamitocin P 3, N-Demethylansamitocin P-3, Ansamitocin P-3, pnd3
| Molecular Formula | C31H41ClN2O9 |
|---|---|
| Molecular Weight | 620.25 g/mol |
| LogP | 4.2993 |
| Topological Polar Surface Area | 144.95 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 620.25006 |
| Heavy Atoms | 43 |
| Complexity | 1314.1677 |
Chemical Identifiers
| CAS Number | 77353-69-6 |
|---|---|
| SMILES | C[C@@H]1[C@@H]2C[C@]([C@@H](/C=C/C=C(/CC3=CC(=C(C(=C3)OC)Cl)NC(=O)C[C@@H]([C@]4([C@H]1O4)C)OC(=O)C(C)C)\C)OC)(NC(=O)O2)O |
Product Overview
Maytansine, 2'-de(acetylmethylamino)-22-demethyl-2'-methyl- (CAS 77353-69-6), with molecular formula C31H41ClN2O9 and molecular weight 620.25 g/mol. IUPAC: [(1S,2R,3S,5S,6S,16E,18E,20R,21S)-11-chloro-21-hydroxy-12,20-dimethoxy-2,5,16-trimethyl-8,23-dioxo-4,24-dioxa-9,22-diazatetracyclo[19.3.1.110,14.03,5]hexacosa-10,12,14(26),16,18-pentaen-6-yl] 2-methylpropanoate.
Chemical Property Profile of Maytansine, 2'-de(acetylmethylamino)-22-demethyl-2'-methyl-
Property Insights of Maytansine, 2'-de(acetylmethylamino)-22-demethyl-2'-methyl-
The XLogP value of 4.2993 indicates that Maytansine, 2'-de(acetylmethylamino)-22-demethyl-2'-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.95 Ų indicates high polarity, suggesting Maytansine, 2'-de(acetylmethylamino)-22-demethyl-2'-methyl- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Maytansine, 2'-de(acetylmethylamino)-22-demethyl-2'-methyl- has 3 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 Maytansine, 2'-de(acetylmethylamino)-22-demethyl-2'-methyl-?
The CAS number of Maytansine, 2'-de(acetylmethylamino)-22-demethyl-2'-methyl- is 77353-69-6.
What is the molecular formula of Maytansine, 2'-de(acetylmethylamino)-22-demethyl-2'-methyl-?
The molecular formula of Maytansine, 2'-de(acetylmethylamino)-22-demethyl-2'-methyl- is C31H41ClN2O9.
What is the molecular weight of Maytansine, 2'-de(acetylmethylamino)-22-demethyl-2'-methyl-?
The molecular weight of Maytansine, 2'-de(acetylmethylamino)-22-demethyl-2'-methyl- is 620.25 g/mol.
Where can I buy Maytansine, 2'-de(acetylmethylamino)-22-demethyl-2'-methyl-?
You can request a quote for Maytansine, 2'-de(acetylmethylamino)-22-demethyl-2'-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Maytansine, 2'-de(acetylmethylamino)-22-demethyl-2'-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Maytansine, 2'-de(acetylmethylamino)-22-demethyl-2'-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.