Cyclic Urea
TL;DR: Cyclic Urea (CAS 153183-50-7) is a chemical compound with molecular formula C35H36N4O5 and molecular weight 592.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[(4R,5S,6S,7R)-4,7-dibenzyl-3-[(3-carbamoylphenyl)methyl]-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]methyl]benzamide
Also Known As: Cyclic Urea, Cyclic urea deriv., 1H-1,3-Diazepine, benzamide deriv., Benzamide, 3,3'-(((4R,5S,6S,7R)-tetrahydro-5,6-dihydroxy-2-oxo-4,7-bis(phenylmethyl)-1H-1,3-diazepine-1,3(2H)-diyl)bis(methylene))bis-, (4aalpha,5alpha,6beta,7beta)-3,3'-(Tetrahydro-5,6-dihydroxy-2-oxo-4,7-bis(phenylmethy)-1H-1,3-diazepine-1,3(2H)-diyl)bis(methylene)bis(benzamide)
| Molecular Formula | C35H36N4O5 |
|---|---|
| Molecular Weight | 592.27 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 150.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 592.26855 |
| Heavy Atoms | 44 |
| Complexity | 893.0 |
Chemical Identifiers
| CAS Number | 153183-50-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C[C@@H]2[C@@H]([C@H]([C@H](N(C(=O)N2CC3=CC(=CC=C3)C(=O)N)CC4=CC(=CC=C4)C(=O)N)CC5=CC=CC=C5)O)O |
| InChIKey | XVBGKELHGBXFDC-ZRTHHSRSSA-N |
Product Overview
Cyclic Urea (CAS 153183-50-7), with molecular formula C35H36N4O5 and molecular weight 592.27 g/mol. IUPAC: 3-[[(4R,5S,6S,7R)-4,7-dibenzyl-3-[(3-carbamoylphenyl)methyl]-5,6-dihydroxy-2-oxo-1,3-diazepan-1-yl]methyl]benzamide.
Chemical Property Profile of Cyclic Urea
Property Insights of Cyclic Urea
The XLogP value of 3.1 indicates that Cyclic Urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 150.0 Ų indicates high polarity, suggesting Cyclic Urea may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cyclic Urea has 4 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 Cyclic Urea?
The CAS number of Cyclic Urea is 153183-50-7.
What is the molecular formula of Cyclic Urea?
The molecular formula of Cyclic Urea is C35H36N4O5.
What is the molecular weight of Cyclic Urea?
The molecular weight of Cyclic Urea is 592.27 g/mol.
Where can I buy Cyclic Urea?
You can request a quote for Cyclic Urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclic Urea?
Yes, KEHONG BIO provides custom synthesis services for Cyclic Urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.