ZERO/004651
TL;DR: ZERO/004651 (CAS 890091-77-7) is a chemical compound with molecular formula C17H20N2O3S and molecular weight 332.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-(3-methoxyphenyl)-7-methyl-3,5-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: ZERO/004651, Ethyl 5-(3-methoxyphenyl)-7-methyl-2,3-dihydro-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl 5-(3-methoxyphenyl)-7-methyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl 5-(3-methoxyphenyl)-7-methyl-2,3-dihydro-5{H}-[1,3]thiazolo[3,2-{a}]pyrimidine-6-carboxylate, ethyl 5-(3-methoxyphenyl)-7-methyl-3,5-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C17H20N2O3S |
|---|---|
| Molecular Weight | 332.12 g/mol |
| LogP | 2.9918 |
| Topological Polar Surface Area | 51.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 332.11948 |
| Heavy Atoms | 23 |
| Complexity | 684.17096 |
Chemical Identifiers
| CAS Number | 890091-77-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC(=CC=C3)OC)CCS2)C |
Product Overview
ZERO/004651 (CAS 890091-77-7), with molecular formula C17H20N2O3S and molecular weight 332.12 g/mol. IUPAC: ethyl 5-(3-methoxyphenyl)-7-methyl-3,5-dihydro-2H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of ZERO/004651
Property Insights of ZERO/004651
The XLogP value of 2.9918 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ZERO/004651. With a topological polar surface area (TPSA) of 51.13 Ų, ZERO/004651 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ZERO/004651 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 ZERO/004651?
The CAS number of ZERO/004651 is 890091-77-7.
What is the molecular formula of ZERO/004651?
The molecular formula of ZERO/004651 is C17H20N2O3S.
What is the molecular weight of ZERO/004651?
The molecular weight of ZERO/004651 is 332.12 g/mol.
Where can I buy ZERO/004651?
You can request a quote for ZERO/004651 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ZERO/004651?
Yes, KEHONG BIO provides custom synthesis services for ZERO/004651 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.