AB00142453-02
TL;DR: AB00142453-02 (CAS 330835-40-0) is a chemical compound with molecular formula C28H26N2O3 and molecular weight 438.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzoyl-6-(4-hydroxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one
Also Known As: AB00142453-02, 11-(4-hydroxyphenyl)-3,3-dimethyl-7-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one, 2-benzoyl-6-(4-hydroxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one, 5-BENZOYL-10-(4-HYDROXYPHENYL)-14,14-DIMETHYL-2,9-DIAZATRICYCLO[9.4.0.0(3),?]PENTADECA-1(11),3,5,7-TETRAEN-12-ONE, 7-benzoyl-11-(4-hydroxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
| Molecular Formula | C28H26N2O3 |
|---|---|
| Molecular Weight | 438.19 g/mol |
| LogP | 5.8451 |
| Topological Polar Surface Area | 78.43 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 438.19434 |
| Heavy Atoms | 33 |
| Complexity | 1274.2545 |
Chemical Identifiers
| CAS Number | 330835-40-0 |
|---|---|
| SMILES | CC1(CC2=C(C(NC3=C(N2)C=C(C=C3)C(=O)C4=CC=CC=C4)C5=CC=C(C=C5)O)C(=O)C1)C |
Product Overview
AB00142453-02 (CAS 330835-40-0), with molecular formula C28H26N2O3 and molecular weight 438.19 g/mol. IUPAC: 2-benzoyl-6-(4-hydroxyphenyl)-9,9-dimethyl-6,8,10,11-tetrahydro-5H-benzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of AB00142453-02
Property Insights of AB00142453-02
The XLogP value of 5.8451 indicates that AB00142453-02 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.43 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00142453-02. Following Lipinski's Rule of Five, AB00142453-02 has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00142453-02?
The CAS number of AB00142453-02 is 330835-40-0.
What is the molecular formula of AB00142453-02?
The molecular formula of AB00142453-02 is C28H26N2O3.
What is the molecular weight of AB00142453-02?
The molecular weight of AB00142453-02 is 438.19 g/mol.
Where can I buy AB00142453-02?
You can request a quote for AB00142453-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00142453-02?
Yes, KEHONG BIO provides custom synthesis services for AB00142453-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.