BAS 01355458
TL;DR: BAS 01355458 (CAS 337502-76-8) is a chemical compound with molecular formula C24H28N2O2S and molecular weight 408.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9,9-dimethyl-5-(3-methylbutanoyl)-6-thiophen-2-yl-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: BAS 01355458, BIM-0039427.P001, 9,9-dimethyl-5-(3-methylbutanoyl)-6-thiophen-2-yl-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one, 3,3-dimethyl-10-(3-methylbutanoyl)-11-(2-thienyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 9,9-dimethyl-5-(3-methylbutanoyl)-6-(2-thienyl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one
| Molecular Formula | C24H28N2O2S |
|---|---|
| Molecular Weight | 408.19 g/mol |
| LogP | 5.9372 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 408.18716 |
| Heavy Atoms | 29 |
| Complexity | 972.5267 |
Chemical Identifiers
| CAS Number | 337502-76-8 |
|---|---|
| SMILES | CC(C)CC(=O)N1C(C2=C(CC(CC2=O)(C)C)NC3=CC=CC=C31)C4=CC=CS4 |
Product Overview
BAS 01355458 (CAS 337502-76-8), with molecular formula C24H28N2O2S and molecular weight 408.19 g/mol. IUPAC: 9,9-dimethyl-5-(3-methylbutanoyl)-6-thiophen-2-yl-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of BAS 01355458
Property Insights of BAS 01355458
The XLogP value of 5.9372 indicates that BAS 01355458 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, BAS 01355458 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01355458 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01355458?
The CAS number of BAS 01355458 is 337502-76-8.
What is the molecular formula of BAS 01355458?
The molecular formula of BAS 01355458 is C24H28N2O2S.
What is the molecular weight of BAS 01355458?
The molecular weight of BAS 01355458 is 408.19 g/mol.
Where can I buy BAS 01355458?
You can request a quote for BAS 01355458 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01355458?
Yes, KEHONG BIO provides custom synthesis services for BAS 01355458 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.