Urea, 1-(2,5-dichlorophenyl)-3-(hexahydro-1H-azepin-1-yl)-
TL;DR: Urea, 1-(2,5-dichlorophenyl)-3-(hexahydro-1H-azepin-1-yl)- (CAS 73953-74-9) is a chemical compound with molecular formula C13H17Cl2N3O and molecular weight 301.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(azepan-1-yl)-3-(2,5-dichlorophenyl)urea
Also Known As: GMPSP, NCIOpen2_009764, 1-azepan-1-yl-3-(2,5-dichlorophenyl)urea, Urea, 1-(2,5-dichlorophenyl)-3-(hexahydro-1H-azepin-1-yl)-, 1-(2,5-Dichlorophenyl)-3-(hexahydro-1H-azepin-1-yl)urea
| Molecular Formula | C13H17Cl2N3O |
|---|---|
| Molecular Weight | 301.07 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 44.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 301.07486 |
| Heavy Atoms | 19 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 73953-74-9 |
|---|---|
| SMILES | C1CCCN(CC1)NC(=O)NC2=C(C=CC(=C2)Cl)Cl |
| InChIKey | SVFSTKOKXZMLIF-UHFFFAOYSA-N |
Product Overview
Urea, 1-(2,5-dichlorophenyl)-3-(hexahydro-1H-azepin-1-yl)- (CAS 73953-74-9), with molecular formula C13H17Cl2N3O and molecular weight 301.07 g/mol. IUPAC: 1-(azepan-1-yl)-3-(2,5-dichlorophenyl)urea.
Chemical Property Profile of Urea, 1-(2,5-dichlorophenyl)-3-(hexahydro-1H-azepin-1-yl)-
Property Insights of Urea, 1-(2,5-dichlorophenyl)-3-(hexahydro-1H-azepin-1-yl)-
The XLogP value of 3.5 indicates that Urea, 1-(2,5-dichlorophenyl)-3-(hexahydro-1H-azepin-1-yl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.4 Ų, Urea, 1-(2,5-dichlorophenyl)-3-(hexahydro-1H-azepin-1-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, 1-(2,5-dichlorophenyl)-3-(hexahydro-1H-azepin-1-yl)- has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Urea, 1-(2,5-dichlorophenyl)-3-(hexahydro-1H-azepin-1-yl)-?
The CAS number of Urea, 1-(2,5-dichlorophenyl)-3-(hexahydro-1H-azepin-1-yl)- is 73953-74-9.
What is the molecular formula of Urea, 1-(2,5-dichlorophenyl)-3-(hexahydro-1H-azepin-1-yl)-?
The molecular formula of Urea, 1-(2,5-dichlorophenyl)-3-(hexahydro-1H-azepin-1-yl)- is C13H17Cl2N3O.
What is the molecular weight of Urea, 1-(2,5-dichlorophenyl)-3-(hexahydro-1H-azepin-1-yl)-?
The molecular weight of Urea, 1-(2,5-dichlorophenyl)-3-(hexahydro-1H-azepin-1-yl)- is 301.07 g/mol.
Where can I buy Urea, 1-(2,5-dichlorophenyl)-3-(hexahydro-1H-azepin-1-yl)-?
You can request a quote for Urea, 1-(2,5-dichlorophenyl)-3-(hexahydro-1H-azepin-1-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-(2,5-dichlorophenyl)-3-(hexahydro-1H-azepin-1-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-(2,5-dichlorophenyl)-3-(hexahydro-1H-azepin-1-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.