美登素
TL;DR: 美登素 (CAS 35846-53-8) is a chemical compound with molecular formula C34H46ClN3O10 and molecular weight 691.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
美登素
(11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-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-[acetyl(methyl)amino]propanoate
Also Known As: Maitansine, Maytansine;Maytansine;NSC 153858;NSC-153858;NSC153858, 11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-8,23-dioxo-4,24-dioxa-9,22-diazatetracyclo[19.3.1.1(1)?,(1)?.0(3),?]hexacosa-10(26),11,13,16,18-pentaen-6-yl 2-(N-methylacetamido)propanoate, 11aChloroCa21ahydroxya12,20adimethoxya2,5,9,16a tetramethyla8,23adioxoa4,24adioxaa9,22a diazatetracyclo[19.3.1.110,14.03,5]hexacosaa 10,12,14(26),16,18apentaena6ayl 2a(Na methylacetamido)propanoate, MTS
| Molecular Formula | C34H46ClN3O10 |
|---|---|
| Molecular Weight | 691.29 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 156.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 691.2872 |
| Heavy Atoms | 48 |
| Complexity | 1300.0 |
Chemical Identifiers
| CAS Number | 35846-53-8 |
|---|---|
| SMILES | CC1C2CC(C(C=CC=C(CC3=CC(=C(C(=C3)OC)Cl)N(C(=O)CC(C4(C1O4)C)OC(=O)C(C)N(C)C(=O)C)C)C)OC)(NC(=O)O2)O |
| InChIKey | WKPWGQKGSOKKOO-UHFFFAOYSA-N |
Product Overview
美登素 (CAS 35846-53-8), with molecular formula C34H46ClN3O10 and molecular weight 691.29 g/mol. IUPAC: (11-chloro-21-hydroxy-12,20-dimethoxy-2,5,9,16-tetramethyl-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-[acetyl(methyl)amino]propanoate.
Chemical Property Profile of 美登素
Property Insights of 美登素
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 美登素. The TPSA of 156.0 Ų indicates high polarity, suggesting 美登素 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 美登素 has 2 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 美登素?
The CAS number of 美登素 is 35846-53-8.
What is the molecular formula of 美登素?
The molecular formula of 美登素 is C34H46ClN3O10.
What is the molecular weight of 美登素?
The molecular weight of 美登素 is 691.29 g/mol.
Where can I buy 美登素?
You can request a quote for 美登素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 美登素?
Yes, KEHONG BIO provides custom synthesis services for 美登素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.