BAS 03541176
TL;DR: BAS 03541176 (CAS 487032-07-5) is a chemical compound with molecular formula C29H31N3O4 and molecular weight 485.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(dimethylamino)propyl]-4-[hydroxy-(2-methyl-4-phenylmethoxyphenyl)methylidene]-5-pyridin-4-ylpyrrolidine-2,3-dione
Also Known As: BAS 03541176, 1-[3-(dimethylamino)propyl]-4-[hydroxy-(2-methyl-4-phenylmethoxyphenyl)methylidene]-5-pyridin-4-ylpyrrolidine-2,3-dione, 4-[4-(benzyloxy)-2-methylbenzoyl]-1-[3-(dimethylamino)propyl]-3-hydroxy-5-(pyridin-4-yl)-2,5-dihydro-1H-pyrrol-2-one
| Molecular Formula | C29H31N3O4 |
|---|---|
| Molecular Weight | 485.23 g/mol |
| LogP | 4.34242 |
| Topological Polar Surface Area | 82.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 485.23145 |
| Heavy Atoms | 36 |
| Complexity | 1256.0256 |
Chemical Identifiers
| CAS Number | 487032-07-5 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)OCC2=CC=CC=C2)C(=C3C(N(C(=O)C3=O)CCCN(C)C)C4=CC=NC=C4)O |
Product Overview
BAS 03541176 (CAS 487032-07-5), with molecular formula C29H31N3O4 and molecular weight 485.23 g/mol. IUPAC: 1-[3-(dimethylamino)propyl]-4-[hydroxy-(2-methyl-4-phenylmethoxyphenyl)methylidene]-5-pyridin-4-ylpyrrolidine-2,3-dione.
Chemical Property Profile of BAS 03541176
Property Insights of BAS 03541176
The XLogP value of 4.34242 indicates that BAS 03541176 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.97 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03541176. Following Lipinski's Rule of Five, BAS 03541176 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 BAS 03541176?
The CAS number of BAS 03541176 is 487032-07-5.
What is the molecular formula of BAS 03541176?
The molecular formula of BAS 03541176 is C29H31N3O4.
What is the molecular weight of BAS 03541176?
The molecular weight of BAS 03541176 is 485.23 g/mol.
Where can I buy BAS 03541176?
You can request a quote for BAS 03541176 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03541176?
Yes, KEHONG BIO provides custom synthesis services for BAS 03541176 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.