AB00874342-06
TL;DR: AB00874342-06 (CAS 888435-87-8) is a chemical compound with molecular formula C19H22N4O4S and molecular weight 402.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methoxyethyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-5H-pyrimido[5,4-b]indol-4-one
Also Known As: AB00874342-06, F1882-1385, 3-(2-methoxyethyl)-2-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-3H,4H,5H-pyrimido[5,4-b]indol-4-one, 3-(2-methoxyethyl)-2-((2-morpholino-2-oxoethyl)thio)-3H-pyrimido[5,4-b]indol-4(5H)-one, 3-(2-methoxyethyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-5H-pyrimido[5,4-b]indol-4-one
| Molecular Formula | C19H22N4O4S |
|---|---|
| Molecular Weight | 402.14 g/mol |
| LogP | 1.4751 |
| Topological Polar Surface Area | 89.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 402.13617 |
| Heavy Atoms | 28 |
| Complexity | 1055.1901 |
Chemical Identifiers
| CAS Number | 888435-87-8 |
|---|---|
| SMILES | COCCN1C(=O)C2=C(C3=CC=CC=C3N2)N=C1SCC(=O)N4CCOCC4 |
Product Overview
AB00874342-06 (CAS 888435-87-8), with molecular formula C19H22N4O4S and molecular weight 402.14 g/mol. IUPAC: 3-(2-methoxyethyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-5H-pyrimido[5,4-b]indol-4-one.
Chemical Property Profile of AB00874342-06
Property Insights of AB00874342-06
The XLogP value of 1.4751 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00874342-06. The TPSA of 89.45 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00874342-06. Following Lipinski's Rule of Five, AB00874342-06 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 AB00874342-06?
The CAS number of AB00874342-06 is 888435-87-8.
What is the molecular formula of AB00874342-06?
The molecular formula of AB00874342-06 is C19H22N4O4S.
What is the molecular weight of AB00874342-06?
The molecular weight of AB00874342-06 is 402.14 g/mol.
Where can I buy AB00874342-06?
You can request a quote for AB00874342-06 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00874342-06?
Yes, KEHONG BIO provides custom synthesis services for AB00874342-06 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.