Hydroxylunine
TL;DR: Hydroxylunine (CAS 30804-86-5) is a chemical compound with molecular formula C16H17NO5 and molecular weight 303.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(13S)-13-(2-hydroxypropan-2-yl)-16-methyl-3,5,14-trioxa-16-azatetracyclo[7.7.0.02,6.011,15]hexadeca-1(9),2(6),7,11(15)-tetraen-10-one
Also Known As: Hydroxylunine, KST-1B2919, J2.704.267H, (13S)-13-(2-hydroxypropan-2-yl)-16-methyl-3,5,14-trioxa-16-azatetracyclo[7.7.0.02,6.011,15]hexadeca-1(9),2(6),7,11(15)-tetraen-10-one, 1,3-dioxolo(4,5-h)furo(2,3-b)quinolin-6(8h)-one, 7,10-dihydro-8-(1-hydroxy-1-methylethyl)-10-methyl-,(s)-
| Molecular Formula | C16H17NO5 |
|---|---|
| Molecular Weight | 303.11 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 68.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 303.1107 |
| Heavy Atoms | 22 |
| Complexity | 543.0 |
Chemical Identifiers
| CAS Number | 30804-86-5 |
|---|---|
| SMILES | CC(C)([C@@H]1CC2=C(O1)N(C3=C(C2=O)C=CC4=C3OCO4)C)O |
| InChIKey | BMARQBOZFYXSII-NSHDSACASA-N |
Product Overview
Hydroxylunine (CAS 30804-86-5), with molecular formula C16H17NO5 and molecular weight 303.11 g/mol. IUPAC: (13S)-13-(2-hydroxypropan-2-yl)-16-methyl-3,5,14-trioxa-16-azatetracyclo[7.7.0.02,6.011,15]hexadeca-1(9),2(6),7,11(15)-tetraen-10-one.
Chemical Property Profile of Hydroxylunine
Property Insights of Hydroxylunine
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydroxylunine. The TPSA of 68.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Hydroxylunine. Following Lipinski's Rule of Five, Hydroxylunine has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hydroxylunine?
The CAS number of Hydroxylunine is 30804-86-5.
What is the molecular formula of Hydroxylunine?
The molecular formula of Hydroxylunine is C16H17NO5.
What is the molecular weight of Hydroxylunine?
The molecular weight of Hydroxylunine is 303.11 g/mol.
Where can I buy Hydroxylunine?
You can request a quote for Hydroxylunine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydroxylunine?
Yes, KEHONG BIO provides custom synthesis services for Hydroxylunine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.