![3,3-Bis[(2-chloro-1,3-thiazol-5-yl)methyl]-2,4-pentanedione structure](/static/products/4782/478247-69-7.webp)
3,3-Bis[(2-chloro-1,3-thiazol-5-yl)methyl]-2,4-pentanedione
TL;DR: 3,3-Bis[(2-chloro-1,3-thiazol-5-yl)methyl]-2,4-pentanedione (CAS 478247-69-7) is a chemical compound with molecular formula C13H12Cl2N2O2S2 and molecular weight 361.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-bis[(2-chloro-1,3-thiazol-5-yl)methyl]pentane-2,4-dione
Also Known As: Bionet1_003721, 3,3-bis[(2-chloro-1,3-thiazol-5-yl)methyl]-2,4-pentanedione, 3,3-bis[(2-chloro-1,3-thiazol-5-yl)methyl]pentane-2,4-dione, 3,3-bis[(2-chlorothiazol-5-yl)methyl]pentane-2,4-dione, 3,3-Bis(2-chloro-1,3-thiazol-5-yl)methyl-2,4-pentanedione
| Molecular Formula | C13H12Cl2N2O2S2 |
|---|---|
| Molecular Weight | 361.97 g/mol |
| LogP | 3.856 |
| Topological Polar Surface Area | 59.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 361.9717 |
| Heavy Atoms | 21 |
| Complexity | 623.0242 |
Chemical Identifiers
| CAS Number | 478247-69-7 |
|---|---|
| SMILES | CC(=O)C(CC1=CN=C(S1)Cl)(CC2=CN=C(S2)Cl)C(=O)C |
Product Overview
3,3-Bis[(2-chloro-1,3-thiazol-5-yl)methyl]-2,4-pentanedione (CAS 478247-69-7), with molecular formula C13H12Cl2N2O2S2 and molecular weight 361.97 g/mol. IUPAC: 3,3-bis[(2-chloro-1,3-thiazol-5-yl)methyl]pentane-2,4-dione.
Chemical Property Profile of 3,3-Bis[(2-chloro-1,3-thiazol-5-yl)methyl]-2,4-pentanedione
Property Insights of 3,3-Bis[(2-chloro-1,3-thiazol-5-yl)methyl]-2,4-pentanedione
The XLogP value of 3.856 indicates that 3,3-Bis[(2-chloro-1,3-thiazol-5-yl)methyl]-2,4-pentanedione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.92 Ų, 3,3-Bis[(2-chloro-1,3-thiazol-5-yl)methyl]-2,4-pentanedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Bis[(2-chloro-1,3-thiazol-5-yl)methyl]-2,4-pentanedione 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 3,3-Bis[(2-chloro-1,3-thiazol-5-yl)methyl]-2,4-pentanedione?
The CAS number of 3,3-Bis[(2-chloro-1,3-thiazol-5-yl)methyl]-2,4-pentanedione is 478247-69-7.
What is the molecular formula of 3,3-Bis[(2-chloro-1,3-thiazol-5-yl)methyl]-2,4-pentanedione?
The molecular formula of 3,3-Bis[(2-chloro-1,3-thiazol-5-yl)methyl]-2,4-pentanedione is C13H12Cl2N2O2S2.
What is the molecular weight of 3,3-Bis[(2-chloro-1,3-thiazol-5-yl)methyl]-2,4-pentanedione?
The molecular weight of 3,3-Bis[(2-chloro-1,3-thiazol-5-yl)methyl]-2,4-pentanedione is 361.97 g/mol.
Where can I buy 3,3-Bis[(2-chloro-1,3-thiazol-5-yl)methyl]-2,4-pentanedione?
You can request a quote for 3,3-Bis[(2-chloro-1,3-thiazol-5-yl)methyl]-2,4-pentanedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Bis[(2-chloro-1,3-thiazol-5-yl)methyl]-2,4-pentanedione?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Bis[(2-chloro-1,3-thiazol-5-yl)methyl]-2,4-pentanedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.