![3-(4-hydroxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one structure](/static/products/374/374757-29-6.png)
3-(4-hydroxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one
TL;DR: 3-(4-hydroxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one (CAS 374757-29-6) is a chemical compound with molecular formula C18H15N3O2 and molecular weight 305.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(4-hydroxyphenyl)ethyl]-5H-pyrimido[5,4-b]indol-4-one
Also Known As: 3-(4-hydroxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one, 3-[2-(4-hydroxyphenyl)ethyl]-5H-pyrimido[5,4-b]indol-4-one, 3-[2-(4-hydroxyphenyl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
| Molecular Formula | C18H15N3O2 |
|---|---|
| Molecular Weight | 305.12 g/mol |
| LogP | 2.8261 |
| Topological Polar Surface Area | 70.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.11642 |
| Heavy Atoms | 23 |
| Complexity | 1045.4347 |
Chemical Identifiers
| CAS Number | 374757-29-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C(N2)C(=O)N(C=N3)CCC4=CC=C(C=C4)O |
Product Overview
3-(4-hydroxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one (CAS 374757-29-6), with molecular formula C18H15N3O2 and molecular weight 305.12 g/mol. IUPAC: 3-[2-(4-hydroxyphenyl)ethyl]-5H-pyrimido[5,4-b]indol-4-one.
Chemical Property Profile of 3-(4-hydroxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one
Property Insights of 3-(4-hydroxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one
The XLogP value of 2.8261 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-hydroxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one. The TPSA of 70.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-hydroxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one. Following Lipinski's Rule of Five, 3-(4-hydroxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one has 2 hydrogen bond donor(s) and 3 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 3-(4-hydroxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one?
The CAS number of 3-(4-hydroxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one is 374757-29-6.
What is the molecular formula of 3-(4-hydroxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one?
The molecular formula of 3-(4-hydroxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one is C18H15N3O2.
What is the molecular weight of 3-(4-hydroxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one?
The molecular weight of 3-(4-hydroxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one is 305.12 g/mol.
Where can I buy 3-(4-hydroxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one?
You can request a quote for 3-(4-hydroxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-hydroxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-hydroxyphenethyl)-3H-pyrimido[5,4-b]indol-4(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.