BAS 00479680
TL;DR: BAS 00479680 (CAS 333393-96-7) is a chemical compound with molecular formula C27H27N3O and molecular weight 409.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-benzylpiperidin-1-yl)methyl]-3-phenyliminoindol-2-one
Also Known As: BAS 00479680, 1-[(4-benzylpiperidin-1-yl)methyl]-3-phenyliminoindol-2-one, (Z)-1-((4-benzylpiperidin-1-yl)methyl)-3-(phenylimino)indolin-2-one, 1-(4-Benzyl-piperidin-1-ylmethyl)-3-phenylimino-1,3-dihydro-indol-2-one, 3-(phenylazamethylene)-1-{[4-benzylpiperidyl]methyl}benzo[d]azolin-2-one
| Molecular Formula | C27H27N3O |
|---|---|
| Molecular Weight | 409.22 g/mol |
| LogP | 5.0662 |
| Topological Polar Surface Area | 35.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 409.21542 |
| Heavy Atoms | 31 |
| Complexity | 1069.9053 |
Chemical Identifiers
| CAS Number | 333393-96-7 |
|---|---|
| SMILES | C1CN(CCC1CC2=CC=CC=C2)CN3C4=CC=CC=C4C(=NC5=CC=CC=C5)C3=O |
Product Overview
BAS 00479680 (CAS 333393-96-7), with molecular formula C27H27N3O and molecular weight 409.22 g/mol. IUPAC: 1-[(4-benzylpiperidin-1-yl)methyl]-3-phenyliminoindol-2-one.
Chemical Property Profile of BAS 00479680
Property Insights of BAS 00479680
The XLogP value of 5.0662 indicates that BAS 00479680 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.91 Ų, BAS 00479680 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00479680 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00479680?
The CAS number of BAS 00479680 is 333393-96-7.
What is the molecular formula of BAS 00479680?
The molecular formula of BAS 00479680 is C27H27N3O.
What is the molecular weight of BAS 00479680?
The molecular weight of BAS 00479680 is 409.22 g/mol.
Where can I buy BAS 00479680?
You can request a quote for BAS 00479680 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00479680?
Yes, KEHONG BIO provides custom synthesis services for BAS 00479680 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.