![N-({3-[(allylamino)carbonyl]-4,5-dihydro-5-isoxazolyl}methyl)-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide structure](/static/products/3214/321432-38-6.webp)
N-({3-[(allylamino)carbonyl]-4,5-dihydro-5-isoxazolyl}methyl)-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide
TL;DR: N-({3-[(allylamino)carbonyl]-4,5-dihydro-5-isoxazolyl}methyl)-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide (CAS 321432-38-6) is a chemical compound with molecular formula C19H19ClN4O4 and molecular weight 402.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chlorophenyl)-5-methyl-N-[[3-(prop-2-enylcarbamoyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]-1,2-oxazole-4-carboxamide
Also Known As: N-({3-[(allylamino)carbonyl]-4,5-dihydro-5-isoxazolyl}methyl)-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide, 3-(2-chlorophenyl)-5-methyl-N-[[3-(prop-2-enylcarbamoyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]-1,2-oxazole-4-carboxamide, 3-(2-chlorophenyl)-5-methyl-N-({3-[(prop-2-en-1-yl)carbamoyl]-4,5-dihydro-1,2-oxazol-5-yl}methyl)-1,2-oxazole-4-carboxamide
| Molecular Formula | C19H19ClN4O4 |
|---|---|
| Molecular Weight | 402.11 g/mol |
| LogP | 2.48032 |
| Topological Polar Surface Area | 105.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 402.1095 |
| Heavy Atoms | 28 |
| Complexity | 937.7649 |
Chemical Identifiers
| CAS Number | 321432-38-6 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=CC=CC=C2Cl)C(=O)NCC3CC(=NO3)C(=O)NCC=C |
Product Overview
N-({3-[(allylamino)carbonyl]-4,5-dihydro-5-isoxazolyl}methyl)-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide (CAS 321432-38-6), with molecular formula C19H19ClN4O4 and molecular weight 402.11 g/mol. IUPAC: 3-(2-chlorophenyl)-5-methyl-N-[[3-(prop-2-enylcarbamoyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl]-1,2-oxazole-4-carboxamide.
Chemical Property Profile of N-({3-[(allylamino)carbonyl]-4,5-dihydro-5-isoxazolyl}methyl)-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide
Property Insights of N-({3-[(allylamino)carbonyl]-4,5-dihydro-5-isoxazolyl}methyl)-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide
The XLogP value of 2.48032 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-({3-[(allylamino)carbonyl]-4,5-dihydro-5-isoxazolyl}methyl)-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide. The TPSA of 105.82 Ų falls within the moderate polarity range, balancing permeability and solubility for N-({3-[(allylamino)carbonyl]-4,5-dihydro-5-isoxazolyl}methyl)-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide. Following Lipinski's Rule of Five, N-({3-[(allylamino)carbonyl]-4,5-dihydro-5-isoxazolyl}methyl)-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide has 2 hydrogen bond donor(s) and 6 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 N-({3-[(allylamino)carbonyl]-4,5-dihydro-5-isoxazolyl}methyl)-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide?
The CAS number of N-({3-[(allylamino)carbonyl]-4,5-dihydro-5-isoxazolyl}methyl)-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide is 321432-38-6.
What is the molecular formula of N-({3-[(allylamino)carbonyl]-4,5-dihydro-5-isoxazolyl}methyl)-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide?
The molecular formula of N-({3-[(allylamino)carbonyl]-4,5-dihydro-5-isoxazolyl}methyl)-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide is C19H19ClN4O4.
What is the molecular weight of N-({3-[(allylamino)carbonyl]-4,5-dihydro-5-isoxazolyl}methyl)-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide?
The molecular weight of N-({3-[(allylamino)carbonyl]-4,5-dihydro-5-isoxazolyl}methyl)-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide is 402.11 g/mol.
Where can I buy N-({3-[(allylamino)carbonyl]-4,5-dihydro-5-isoxazolyl}methyl)-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide?
You can request a quote for N-({3-[(allylamino)carbonyl]-4,5-dihydro-5-isoxazolyl}methyl)-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-({3-[(allylamino)carbonyl]-4,5-dihydro-5-isoxazolyl}methyl)-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-({3-[(allylamino)carbonyl]-4,5-dihydro-5-isoxazolyl}methyl)-3-(2-chlorophenyl)-5-methyl-4-isoxazolecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.