ChemDiv1_016006
TL;DR: ChemDiv1_016006 (CAS 346714-75-8) is a chemical compound with molecular formula C29H29N3O4 and molecular weight 483.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[9-(3,4-dimethoxyphenyl)-7-oxo-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-6-yl]phenyl]acetamide
Also Known As: ChemDiv1_016006, MixCom6_000166, BAS 02841980, BIM-0046056.P001, A2470/0104876
| Molecular Formula | C29H29N3O4 |
|---|---|
| Molecular Weight | 483.22 g/mol |
| LogP | 5.6417 |
| Topological Polar Surface Area | 88.69 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 483.21582 |
| Heavy Atoms | 36 |
| Complexity | 1346.8801 |
Chemical Identifiers
| CAS Number | 346714-75-8 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC(=C(C=C4)OC)OC)NC5=CC=CC=C5N2 |
Product Overview
ChemDiv1_016006 (CAS 346714-75-8), with molecular formula C29H29N3O4 and molecular weight 483.22 g/mol. IUPAC: N-[4-[9-(3,4-dimethoxyphenyl)-7-oxo-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-6-yl]phenyl]acetamide.
Chemical Property Profile of ChemDiv1_016006
Property Insights of ChemDiv1_016006
The XLogP value of 5.6417 indicates that ChemDiv1_016006 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.69 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_016006. Following Lipinski's Rule of Five, ChemDiv1_016006 has 3 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 ChemDiv1_016006?
The CAS number of ChemDiv1_016006 is 346714-75-8.
What is the molecular formula of ChemDiv1_016006?
The molecular formula of ChemDiv1_016006 is C29H29N3O4.
What is the molecular weight of ChemDiv1_016006?
The molecular weight of ChemDiv1_016006 is 483.22 g/mol.
Where can I buy ChemDiv1_016006?
You can request a quote for ChemDiv1_016006 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_016006?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_016006 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.