![2-hydroxyethyl[?]one structure](/static/products/806/80616-22-4.png)
2-hydroxyethyl[?]one
TL;DR: 2-hydroxyethyl[?]one (CAS 80616-22-4) is a chemical compound with molecular formula C19H21N3O2 and molecular weight 323.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
15-(2-hydroxyethyl)-3,13,15-triazapentacyclo[11.7.0.01,16.02,10.04,9]icosa-2(10),4,6,8,16-pentaen-14-one
Also Known As: 2-hydroxyethyl[?]one, 5-(2-Hydroxyethyl)-1,2,3,5,9,14-hexahydro-6H,8H-indolo(2',3':3,4)pyrido(1,2-c)benzimidazol-6-one, 2,3,9,14-tetrahydro-5-(2-hydroxyethyl)-1H,8H-indolopyridoben, 5-(2-Hydroxyethyl)-1,2,3,5,9,14-hexahydro-6H,8H-indolo[2',3':3,4]pyrido[1,2-c]benzimidazol-6-one
| Molecular Formula | C19H21N3O2 |
|---|---|
| Molecular Weight | 323.16 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 59.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 323.1634 |
| Heavy Atoms | 24 |
| Complexity | 577.0 |
Chemical Identifiers
| CAS Number | 80616-22-4 |
|---|---|
| SMILES | C1CC=C2C3(C1)C4=C(CCN3C(=O)N2CCO)C5=CC=CC=C5N4 |
| InChIKey | NOLNWGBCVLODMZ-UHFFFAOYSA-N |
Product Overview
2-hydroxyethyl[?]one (CAS 80616-22-4), with molecular formula C19H21N3O2 and molecular weight 323.16 g/mol. IUPAC: 15-(2-hydroxyethyl)-3,13,15-triazapentacyclo[11.7.0.01,16.02,10.04,9]icosa-2(10),4,6,8,16-pentaen-14-one.
Chemical Property Profile of 2-hydroxyethyl[?]one
Property Insights of 2-hydroxyethyl[?]one
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-hydroxyethyl[?]one. With a topological polar surface area (TPSA) of 59.6 Ų, 2-hydroxyethyl[?]one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-hydroxyethyl[?]one has 2 hydrogen bond donor(s) and 2 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 2-hydroxyethyl[?]one?
The CAS number of 2-hydroxyethyl[?]one is 80616-22-4.
What is the molecular formula of 2-hydroxyethyl[?]one?
The molecular formula of 2-hydroxyethyl[?]one is C19H21N3O2.
What is the molecular weight of 2-hydroxyethyl[?]one?
The molecular weight of 2-hydroxyethyl[?]one is 323.16 g/mol.
Where can I buy 2-hydroxyethyl[?]one?
You can request a quote for 2-hydroxyethyl[?]one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-hydroxyethyl[?]one?
Yes, KEHONG BIO provides custom synthesis services for 2-hydroxyethyl[?]one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.