AB01304401-01
TL;DR: AB01304401-01 (CAS 900896-45-9) is a chemical compound with molecular formula C22H29N3O3S and molecular weight 415.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-2-[[2-(4-methoxyphenyl)-7,7-dimethyl-5,8-dihydropyrano[4,3-d]pyrimidin-4-yl]sulfanyl]acetamide
Also Known As: AB01304401-01, N,N-diethyl-2-((2-(4-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)acetamide, N,N-diethyl-2-[[2-(4-methoxyphenyl)-7,7-dimethyl-5,8-dihydropyrano[4,3-d]pyrimidin-4-yl]sulfanyl]acetamide, N,N-diethyl-2-{[2-(4-methoxyphenyl)-7,7-dimethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}acetamide
| Molecular Formula | C22H29N3O3S |
|---|---|
| Molecular Weight | 415.19 g/mol |
| LogP | 3.964 |
| Topological Polar Surface Area | 64.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 415.19296 |
| Heavy Atoms | 29 |
| Complexity | 864.3514 |
Chemical Identifiers
| CAS Number | 900896-45-9 |
|---|---|
| SMILES | CCN(CC)C(=O)CSC1=NC(=NC2=C1COC(C2)(C)C)C3=CC=C(C=C3)OC |
Product Overview
AB01304401-01 (CAS 900896-45-9), with molecular formula C22H29N3O3S and molecular weight 415.19 g/mol. IUPAC: N,N-diethyl-2-[[2-(4-methoxyphenyl)-7,7-dimethyl-5,8-dihydropyrano[4,3-d]pyrimidin-4-yl]sulfanyl]acetamide.
Chemical Property Profile of AB01304401-01
Property Insights of AB01304401-01
The XLogP value of 3.964 indicates that AB01304401-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.55 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01304401-01. Following Lipinski's Rule of Five, AB01304401-01 has 0 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 AB01304401-01?
The CAS number of AB01304401-01 is 900896-45-9.
What is the molecular formula of AB01304401-01?
The molecular formula of AB01304401-01 is C22H29N3O3S.
What is the molecular weight of AB01304401-01?
The molecular weight of AB01304401-01 is 415.19 g/mol.
Where can I buy AB01304401-01?
You can request a quote for AB01304401-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01304401-01?
Yes, KEHONG BIO provides custom synthesis services for AB01304401-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.