BRD-K72854501-001-10-1
TL;DR: BRD-K72854501-001-10-1 (CAS 577986-34-6) is a chemical compound with molecular formula C30H35N3O5 and molecular weight 517.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[11-[2-(diethylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]-3,4,5-trimethoxybenzamide
Also Known As: BRD-K72854501-001-10-1, N-(5-(2-(diethylamino)acetyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl)-3,4,5-trimethoxybenzamide, N-[11-[2-(diethylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]-3,4,5-trimethoxybenzamide, N-[5-(2-Diethylamino-acetyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl]-3,4,5-trimethoxy-benzamide, N-[5-(N,N-diethylglycyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl]-3,4,5-trimethoxybenzamide
| Molecular Formula | C30H35N3O5 |
|---|---|
| Molecular Weight | 517.26 g/mol |
| LogP | 5.0698 |
| Topological Polar Surface Area | 80.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 517.2577 |
| Heavy Atoms | 38 |
| Complexity | 1293.9856 |
Chemical Identifiers
| CAS Number | 577986-34-6 |
|---|---|
| SMILES | CCN(CC)CC(=O)N1C2=CC=CC=C2CCC3=C1C=C(C=C3)NC(=O)C4=CC(=C(C(=C4)OC)OC)OC |
Product Overview
BRD-K72854501-001-10-1 (CAS 577986-34-6), with molecular formula C30H35N3O5 and molecular weight 517.26 g/mol. IUPAC: N-[11-[2-(diethylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]-3,4,5-trimethoxybenzamide.
Chemical Property Profile of BRD-K72854501-001-10-1
Property Insights of BRD-K72854501-001-10-1
The XLogP value of 5.0698 indicates that BRD-K72854501-001-10-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.34 Ų falls within the moderate polarity range, balancing permeability and solubility for BRD-K72854501-001-10-1. Following Lipinski's Rule of Five, BRD-K72854501-001-10-1 has 1 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 BRD-K72854501-001-10-1?
The CAS number of BRD-K72854501-001-10-1 is 577986-34-6.
What is the molecular formula of BRD-K72854501-001-10-1?
The molecular formula of BRD-K72854501-001-10-1 is C30H35N3O5.
What is the molecular weight of BRD-K72854501-001-10-1?
The molecular weight of BRD-K72854501-001-10-1 is 517.26 g/mol.
Where can I buy BRD-K72854501-001-10-1?
You can request a quote for BRD-K72854501-001-10-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRD-K72854501-001-10-1?
Yes, KEHONG BIO provides custom synthesis services for BRD-K72854501-001-10-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.