BAS 00485277
TL;DR: BAS 00485277 (CAS 313377-72-9) is a chemical compound with molecular formula C24H27N3O4 and molecular weight 421.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(2,4-dimethylphenyl)pyrrolidine-2,5-dione
Also Known As: BAS 00485277, 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(2,4-dimethylphenyl)pyrrolidine-2,5-dione, AB00087722-01, 3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-(2,4-dimethylphenyl)-2,5-pyrrolidinedione, A1138/0053212
| Molecular Formula | C24H27N3O4 |
|---|---|
| Molecular Weight | 421.20 g/mol |
| LogP | 2.48184 |
| Topological Polar Surface Area | 62.32 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 421.20016 |
| Heavy Atoms | 31 |
| Complexity | 1029.4796 |
Chemical Identifiers
| CAS Number | 313377-72-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)N2C(=O)CC(C2=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)C |
Product Overview
BAS 00485277 (CAS 313377-72-9), with molecular formula C24H27N3O4 and molecular weight 421.20 g/mol. IUPAC: 3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(2,4-dimethylphenyl)pyrrolidine-2,5-dione.
Chemical Property Profile of BAS 00485277
Property Insights of BAS 00485277
The XLogP value of 2.48184 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00485277. The TPSA of 62.32 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00485277. Following Lipinski's Rule of Five, BAS 00485277 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 BAS 00485277?
The CAS number of BAS 00485277 is 313377-72-9.
What is the molecular formula of BAS 00485277?
The molecular formula of BAS 00485277 is C24H27N3O4.
What is the molecular weight of BAS 00485277?
The molecular weight of BAS 00485277 is 421.20 g/mol.
Where can I buy BAS 00485277?
You can request a quote for BAS 00485277 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00485277?
Yes, KEHONG BIO provides custom synthesis services for BAS 00485277 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.