D0EG1F
TL;DR: D0EG1F (CAS 162271-54-7) is a chemical compound with molecular formula C28H32FN5O4 and molecular weight 521.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3S)-5-cyclohexyl-2,4-dioxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)-1,5-benzodiazepin-3-yl]-3-(4-fluorophenyl)urea
Also Known As: GR-199114X
| Molecular Formula | C28H32FN5O4 |
|---|---|
| Molecular Weight | 521.24 g/mol |
| LogP | 3.6507 |
| Topological Polar Surface Area | 102.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 521.24384 |
| Heavy Atoms | 38 |
| Complexity | 1207.9796 |
Chemical Identifiers
| CAS Number | 162271-54-7 |
|---|---|
| SMILES | C1CCC(CC1)N2C3=CC=CC=C3N(C(=O)[C@@H](C2=O)NC(=O)NC4=CC=C(C=C4)F)CC(=O)N5CCCC5 |
Product Overview
D0EG1F (CAS 162271-54-7), with molecular formula C28H32FN5O4 and molecular weight 521.24 g/mol. IUPAC: 1-[(3S)-5-cyclohexyl-2,4-dioxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)-1,5-benzodiazepin-3-yl]-3-(4-fluorophenyl)urea.
Chemical Property Profile of D0EG1F
Property Insights of D0EG1F
The XLogP value of 3.6507 indicates that D0EG1F is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.06 Ų falls within the moderate polarity range, balancing permeability and solubility for D0EG1F. Following Lipinski's Rule of Five, D0EG1F has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of D0EG1F?
The CAS number of D0EG1F is 162271-54-7.
What is the molecular formula of D0EG1F?
The molecular formula of D0EG1F is C28H32FN5O4.
What is the molecular weight of D0EG1F?
The molecular weight of D0EG1F is 521.24 g/mol.
Where can I buy D0EG1F?
You can request a quote for D0EG1F directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D0EG1F?
Yes, KEHONG BIO provides custom synthesis services for D0EG1F and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.