5-Iminomorpholinoadriamycin
TL;DR: 5-Iminomorpholinoadriamycin (CAS 89196-05-4) is a chemical compound with molecular formula C31H36N2O11 and molecular weight 612.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,8,11-trihydroxy-8-(2-hydroxyacetyl)-10-(5-hydroxy-6-methyl-4-morpholin-4-yloxan-2-yl)oxy-12-imino-1-methoxy-9,10-dihydro-7H-tetracen-5-one
Also Known As: 5-Iminomorpholinoadriamycin, 3'-Deamino-3'-(4-morpholinyl)-12-iminoadriamycin hydrochloride, 5(8H)-Naphthacenone, 7,9,10,12-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-12-imino-1-methoxy-10-((2,3,6-trideoxy-3-(4-morpholinyl)-alpha-L-lyxo-hexopyranosyl)oxy)-, monohydrochloride, (8S-cis)-, (8S-cis)-7,9,10,12-Tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-12-imino-1-methoxy-10-((2,3,6-trideoxy-3-(4-morpholinyl)-alpha-L-lyxo-hexopyranosyl)oxy)-5(8H)-naphthacenone monohydrochloride, 5(8H)-Naphthacenone, 7,9,10,12-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-12-imino-1-methoxy-10-((2,3,6-trideoxy-3-(4-morpholinyl)-alpha-L-lyxo-hexopyranosyl)oxy)-, (8S-cis)-
| Molecular Formula | C31H36N2O11 |
|---|---|
| Molecular Weight | 612.23 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 199.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 6 |
| Exact Mass | 612.23193 |
| Heavy Atoms | 44 |
| Complexity | 1100.0 |
Chemical Identifiers
| CAS Number | 89196-05-4 |
|---|---|
| SMILES | CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=N)C(=CC=C5)OC)O)(C(=O)CO)O)N6CCOCC6)O |
| InChIKey | HPZCCJXRTVUZHT-UHFFFAOYSA-N |
Product Overview
5-Iminomorpholinoadriamycin (CAS 89196-05-4), with molecular formula C31H36N2O11 and molecular weight 612.23 g/mol. IUPAC: 6,8,11-trihydroxy-8-(2-hydroxyacetyl)-10-(5-hydroxy-6-methyl-4-morpholin-4-yloxan-2-yl)oxy-12-imino-1-methoxy-9,10-dihydro-7H-tetracen-5-one.
Chemical Property Profile of 5-Iminomorpholinoadriamycin
Property Insights of 5-Iminomorpholinoadriamycin
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Iminomorpholinoadriamycin. The TPSA of 199.0 Ų indicates high polarity, suggesting 5-Iminomorpholinoadriamycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-Iminomorpholinoadriamycin has 6 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Iminomorpholinoadriamycin?
The CAS number of 5-Iminomorpholinoadriamycin is 89196-05-4.
What is the molecular formula of 5-Iminomorpholinoadriamycin?
The molecular formula of 5-Iminomorpholinoadriamycin is C31H36N2O11.
What is the molecular weight of 5-Iminomorpholinoadriamycin?
The molecular weight of 5-Iminomorpholinoadriamycin is 612.23 g/mol.
Where can I buy 5-Iminomorpholinoadriamycin?
You can request a quote for 5-Iminomorpholinoadriamycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Iminomorpholinoadriamycin?
Yes, KEHONG BIO provides custom synthesis services for 5-Iminomorpholinoadriamycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.