BAS 01404336
TL;DR: BAS 01404336 (CAS 330952-33-5) is a chemical compound with molecular formula C23H26N2O4 and molecular weight 394.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-hydroxy-3,5-dimethoxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
Also Known As: BAS 01404336, 10-(4-hydroxy-3,5-dimethoxyphenyl)-14,14-dimethyl-2,9-diazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6-tetraen-12-one, 11-(4-hydroxy-3,5-dimethoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 6-(4-hydroxy-3,5-dimethoxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one, 10-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-14,14-DIMETHYL-2,9-DIAZATRICYCLO[9.4.0.0(3),?]PENTADECA-1(11),3,5,7-TETRAEN-12-ONE
| Molecular Formula | C23H26N2O4 |
|---|---|
| Molecular Weight | 394.19 g/mol |
| LogP | 4.6313 |
| Topological Polar Surface Area | 79.82 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 394.18927 |
| Heavy Atoms | 29 |
| Complexity | 984.68256 |
Chemical Identifiers
| CAS Number | 330952-33-5 |
|---|---|
| SMILES | CC1(CC2=C(C(NC3=CC=CC=C3N2)C4=CC(=C(C(=C4)OC)O)OC)C(=O)C1)C |
Product Overview
BAS 01404336 (CAS 330952-33-5), with molecular formula C23H26N2O4 and molecular weight 394.19 g/mol. IUPAC: 6-(4-hydroxy-3,5-dimethoxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of BAS 01404336
Property Insights of BAS 01404336
The XLogP value of 4.6313 indicates that BAS 01404336 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.82 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01404336. Following Lipinski's Rule of Five, BAS 01404336 has 3 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 01404336?
The CAS number of BAS 01404336 is 330952-33-5.
What is the molecular formula of BAS 01404336?
The molecular formula of BAS 01404336 is C23H26N2O4.
What is the molecular weight of BAS 01404336?
The molecular weight of BAS 01404336 is 394.19 g/mol.
Where can I buy BAS 01404336?
You can request a quote for BAS 01404336 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01404336?
Yes, KEHONG BIO provides custom synthesis services for BAS 01404336 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.