![1-(1-Adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea structure](/static/products/957/957320-18-2.png)
1-(1-Adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea
TL;DR: 1-(1-Adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea (CAS 957320-18-2) is a chemical compound with molecular formula C18H28N4O and molecular weight 316.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea
Also Known As: CBKinase1_006856, CBKinase1_019256, 1-(1-adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea, BRD-K12666236-001-01-3, (adamantanylamino)-N-[3-(4-methylpyrazolyl)propyl]carboxamide
| Molecular Formula | C18H28N4O |
|---|---|
| Molecular Weight | 316.23 g/mol |
| LogP | 2.84962 |
| Topological Polar Surface Area | 58.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 316.22632 |
| Heavy Atoms | 23 |
| Complexity | 544.0474 |
Chemical Identifiers
| CAS Number | 957320-18-2 |
|---|---|
| SMILES | CC1=CN(N=C1)CCCNC(=O)NC23CC4CC(C2)CC(C4)C3 |
Product Overview
1-(1-Adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea (CAS 957320-18-2), with molecular formula C18H28N4O and molecular weight 316.23 g/mol. IUPAC: 1-(1-adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea.
Chemical Property Profile of 1-(1-Adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea
Property Insights of 1-(1-Adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea
The XLogP value of 2.84962 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1-Adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea. With a topological polar surface area (TPSA) of 58.95 Ų, 1-(1-Adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-Adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea 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 1-(1-Adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea?
The CAS number of 1-(1-Adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea is 957320-18-2.
What is the molecular formula of 1-(1-Adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea?
The molecular formula of 1-(1-Adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea is C18H28N4O.
What is the molecular weight of 1-(1-Adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea?
The molecular weight of 1-(1-Adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea is 316.23 g/mol.
Where can I buy 1-(1-Adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea?
You can request a quote for 1-(1-Adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-Adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-Adamantyl)-3-[3-(4-methylpyrazol-1-yl)propyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.