DATPN
TL;DR: DATPN (CAS 109485-64-5) is a chemical compound with molecular formula C29H34ClNO9 and molecular weight 575.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-6,9,11-trihydroxy-9-pentanoyl-8,10-dihydro-7H-tetracene-5,12-dione;hydrochloride
Also Known As: DATPN, Undecane,2,2,4,4,6,6,8,8,10-nonamethyl, 4(O)-Daunosaminyl-2,4,5,12-tetrahydroxy-2-pentanoyl-1,2,3,4-tetrahydro-6,11-naphthacenedione, 7-((3-Amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-6,9,11-trihydroxy-9-(1-oxopentyl)-5,12-naphthacenedione hydrochloride, (7s-cis)-, 3,5,12-Trihydroxy-6,11-dioxo-3-pentanoyl-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxyhexopyranoside--hydrogen chloride (1/1)
| Molecular Formula | C29H34ClNO9 |
|---|---|
| Molecular Weight | 575.19 g/mol |
| LogP | 2.6124 |
| Topological Polar Surface Area | 177.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 575.1922 |
| Heavy Atoms | 40 |
| Complexity | 959.0 |
Chemical Identifiers
| CAS Number | 109485-64-5 |
|---|---|
| SMILES | CCCCC(=O)C1(CC(C2=C(C1)C(=C3C(=C2O)C(=O)C4=CC=CC=C4C3=O)O)OC5CC(C(C(O5)C)O)N)O.Cl |
| InChIKey | UURZVEUAJLBIKP-UHFFFAOYSA-N |
Product Overview
DATPN (CAS 109485-64-5), with molecular formula C29H34ClNO9 and molecular weight 575.19 g/mol. IUPAC: 7-(4-amino-5-hydroxy-6-methyloxan-2-yl)oxy-6,9,11-trihydroxy-9-pentanoyl-8,10-dihydro-7H-tetracene-5,12-dione;hydrochloride.
Chemical Property Profile of DATPN
Property Insights of DATPN
The XLogP value of 2.6124 suggests moderate lipophilicity, balancing water solubility and membrane permeability for DATPN. The TPSA of 177.0 Ų indicates high polarity, suggesting DATPN may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, DATPN has 6 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 DATPN?
The CAS number of DATPN is 109485-64-5.
What is the molecular formula of DATPN?
The molecular formula of DATPN is C29H34ClNO9.
What is the molecular weight of DATPN?
The molecular weight of DATPN is 575.19 g/mol.
Where can I buy DATPN?
You can request a quote for DATPN directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DATPN?
Yes, KEHONG BIO provides custom synthesis services for DATPN and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.