BAS 02101854
TL;DR: BAS 02101854 (CAS 354538-75-3) is a chemical compound with molecular formula C30H30N2O4 and molecular weight 482.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzoyl-6-(3,4-dimethoxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
Also Known As: BAS 02101854, 8-benzoyl-11-(3,4-dimethoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 3-benzoyl-6-(3,4-dimethoxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one, 11-(3,4-dimethoxyphenyl)-3,3-dimethyl-8-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 11-(3,4-dimethoxyphenyl)-3,3-dimethyl-8-(phenylcarbonyl)-2,3,4-trihydro-5H,10H ,11H-benzo[b]benzo[2,1-f]1,4-diazepin-1-one
| Molecular Formula | C30H30N2O4 |
|---|---|
| Molecular Weight | 482.22 g/mol |
| LogP | 6.1567 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 482.22055 |
| Heavy Atoms | 36 |
| Complexity | 1374.9512 |
Chemical Identifiers
| CAS Number | 354538-75-3 |
|---|---|
| SMILES | CC1(CC2=C(C(NC3=C(N2)C=CC(=C3)C(=O)C4=CC=CC=C4)C5=CC(=C(C=C5)OC)OC)C(=O)C1)C |
Product Overview
BAS 02101854 (CAS 354538-75-3), with molecular formula C30H30N2O4 and molecular weight 482.22 g/mol. IUPAC: 3-benzoyl-6-(3,4-dimethoxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of BAS 02101854
Property Insights of BAS 02101854
The XLogP value of 6.1567 indicates that BAS 02101854 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02101854. Following Lipinski's Rule of Five, BAS 02101854 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02101854?
The CAS number of BAS 02101854 is 354538-75-3.
What is the molecular formula of BAS 02101854?
The molecular formula of BAS 02101854 is C30H30N2O4.
What is the molecular weight of BAS 02101854?
The molecular weight of BAS 02101854 is 482.22 g/mol.
Where can I buy BAS 02101854?
You can request a quote for BAS 02101854 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02101854?
Yes, KEHONG BIO provides custom synthesis services for BAS 02101854 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.