![(4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate structure](/static/products/339/339337-74-5.png)
(4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate
TL;DR: (4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate (CAS 339337-74-5) is a chemical compound with molecular formula C23H31N3O4 and molecular weight 413.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate
Also Known As: (4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate, (E)-4-methoxybenzyl 2-(4-(adamantan-1-ylamino)-4-oxobutan-2-ylidene)hydrazinecarboxylate, (3E)-N-(ADAMANTAN-1-YL)-3-[({[(4-METHOXYPHENYL)METHOXY]CARBONYL}AMINO)IMINO]BUTANAMIDE, (3E)-N-adamantanyl-4-{[(4-methoxyphenyl)methoxy]carbonylamino}-3-methyl-4-azab ut-3-enamide, 4-methoxybenzyl (2E)-2-[4-oxo-4-(tricyclo[3.3.1.1~3,7~]dec-1-ylamino)butan-2-ylidene]hydrazinecarboxylate
| Molecular Formula | C23H31N3O4 |
|---|---|
| Molecular Weight | 413.23 g/mol |
| LogP | 3.7724 |
| Topological Polar Surface Area | 89.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 413.23145 |
| Heavy Atoms | 30 |
| Complexity | 782.9578 |
Chemical Identifiers
| CAS Number | 339337-74-5 |
|---|---|
| SMILES | C/C(=N\NC(=O)OCC1=CC=C(C=C1)OC)/CC(=O)NC23CC4CC(C2)CC(C4)C3 |
Product Overview
(4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate (CAS 339337-74-5), with molecular formula C23H31N3O4 and molecular weight 413.23 g/mol. IUPAC: (4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate.
Chemical Property Profile of (4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate
Property Insights of (4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate
The XLogP value of 3.7724 indicates that (4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.02 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate. Following Lipinski's Rule of Five, (4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate has 2 hydrogen bond donor(s) and 5 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 (4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate?
The CAS number of (4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate is 339337-74-5.
What is the molecular formula of (4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate?
The molecular formula of (4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate is C23H31N3O4.
What is the molecular weight of (4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate?
The molecular weight of (4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate is 413.23 g/mol.
Where can I buy (4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate?
You can request a quote for (4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate?
Yes, KEHONG BIO provides custom synthesis services for (4-methoxyphenyl)methyl N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.