Butane, 1,4-bis(3-phenylureido)-
TL;DR: Butane, 1,4-bis(3-phenylureido)- (CAS 64544-76-9) is a chemical compound with molecular formula C18H22N4O2 and molecular weight 326.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-3-[4-(phenylcarbamoylamino)butyl]urea
Also Known As: Butane, 1,4-bis(3-phenylureido)-, 1-phenyl-3-[4-(phenylcarbamoylamino)butyl]urea, Urea, N,N''-1,4-butanediylbis[N'-phenyl-, 1,1 -Tetramethylenebis(3-phenylurea), N,N'-Butane-1,4-diylbis(N'-phenylurea)
| Molecular Formula | C18H22N4O2 |
|---|---|
| Molecular Weight | 326.17 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 82.3 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 326.1743 |
| Heavy Atoms | 24 |
| Complexity | 341.0 |
Chemical Identifiers
| CAS Number | 64544-76-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)NCCCCNC(=O)NC2=CC=CC=C2 |
| InChIKey | ZIXMLGUIEKQAQC-UHFFFAOYSA-N |
Product Overview
Butane, 1,4-bis(3-phenylureido)- (CAS 64544-76-9), with molecular formula C18H22N4O2 and molecular weight 326.17 g/mol. IUPAC: 1-phenyl-3-[4-(phenylcarbamoylamino)butyl]urea.
Chemical Property Profile of Butane, 1,4-bis(3-phenylureido)-
Property Insights of Butane, 1,4-bis(3-phenylureido)-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butane, 1,4-bis(3-phenylureido)-. The TPSA of 82.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Butane, 1,4-bis(3-phenylureido)-. Following Lipinski's Rule of Five, Butane, 1,4-bis(3-phenylureido)- has 4 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 Butane, 1,4-bis(3-phenylureido)-?
The CAS number of Butane, 1,4-bis(3-phenylureido)- is 64544-76-9.
What is the molecular formula of Butane, 1,4-bis(3-phenylureido)-?
The molecular formula of Butane, 1,4-bis(3-phenylureido)- is C18H22N4O2.
What is the molecular weight of Butane, 1,4-bis(3-phenylureido)-?
The molecular weight of Butane, 1,4-bis(3-phenylureido)- is 326.17 g/mol.
Where can I buy Butane, 1,4-bis(3-phenylureido)-?
You can request a quote for Butane, 1,4-bis(3-phenylureido)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butane, 1,4-bis(3-phenylureido)-?
Yes, KEHONG BIO provides custom synthesis services for Butane, 1,4-bis(3-phenylureido)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.