N-ethoxycarbonyl-7-oxostaurosporine
TL;DR: N-ethoxycarbonyl-7-oxostaurosporine (CAS 143086-33-3) is a chemical compound with molecular formula C31H28N4O6 and molecular weight 552.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[(2S,3S,4R,6S)-3-methoxy-2-methyl-16,18-dioxo-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-4-yl]-N-methylcarbamate
Also Known As: N-Ethoxycarbonyl-7-oxostaurosporine, NA 382, N-ethoxycarbonyl-7-oxo-staurosporine, ethyl N-[(2S,3S,4R,6S)-3-methoxy-2-methyl-16,18-dioxo-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-4-yl]-N-methylcarbamate, Carbamic acid, (2,3,10,11,12,13-hexahydro-10-methoxy-9-methyl-1,3-dioxo-9,13-epoxy-1H,9H-diindolo(1,2,3-gh:3',2',1'-lm)pyrrolo(3,4-j)(1,7)benzodiazonin-11-yl)methyl-, ethyl ester, (9alpha,10beta,11beta,13alpha)-
| Molecular Formula | C31H28N4O6 |
|---|---|
| Molecular Weight | 552.20 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 552.20087 |
| Heavy Atoms | 41 |
| Complexity | 1140.0 |
Chemical Identifiers
| CAS Number | 143086-33-3 |
|---|---|
| SMILES | CCOC(=O)N(C)[C@@H]1C[C@H]2N3C4=CC=CC=C4C5=C6C(=C7C8=CC=CC=C8N(C7=C53)[C@]([C@H]1OC)(O2)C)C(=O)NC6=O |
| InChIKey | YYDZNUMDZXMMCI-ZEMYHKRKSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-ethoxycarbonyl-7-oxostaurosporine (CAS 143086-33-3), with molecular formula C31H28N4O6 and molecular weight 552.20 g/mol. IUPAC: ethyl N-[(2S,3S,4R,6S)-3-methoxy-2-methyl-16,18-dioxo-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-4-yl]-N-methylcarbamate.
Chemical Property Profile of N-ethoxycarbonyl-7-oxostaurosporine
Property Insights of N-ethoxycarbonyl-7-oxostaurosporine
The XLogP value of 3.9 indicates that N-ethoxycarbonyl-7-oxostaurosporine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-ethoxycarbonyl-7-oxostaurosporine. Following Lipinski's Rule of Five, N-ethoxycarbonyl-7-oxostaurosporine has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-ethoxycarbonyl-7-oxostaurosporine?
The CAS number of N-ethoxycarbonyl-7-oxostaurosporine is 143086-33-3.
What is the molecular formula of N-ethoxycarbonyl-7-oxostaurosporine?
The molecular formula of N-ethoxycarbonyl-7-oxostaurosporine is C31H28N4O6.
What is the molecular weight of N-ethoxycarbonyl-7-oxostaurosporine?
The molecular weight of N-ethoxycarbonyl-7-oxostaurosporine is 552.20 g/mol.
Where can I buy N-ethoxycarbonyl-7-oxostaurosporine?
You can request a quote for N-ethoxycarbonyl-7-oxostaurosporine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-ethoxycarbonyl-7-oxostaurosporine?
Yes, KEHONG BIO provides custom synthesis services for N-ethoxycarbonyl-7-oxostaurosporine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.