![1,4-Anhydro-1-{3-carbamoyl-5-[hydroxy(imino)methyl]-4,5-dihydro-1,2-oxazol-4-yl}pentitol structure](/static/products/7267/72671-95-5.webp)
1,4-Anhydro-1-{3-carbamoyl-5-[hydroxy(imino)methyl]-4,5-dihydro-1,2-oxazol-4-yl}pentitol
TL;DR: 1,4-Anhydro-1-{3-carbamoyl-5-[hydroxy(imino)methyl]-4,5-dihydro-1,2-oxazol-4-yl}pentitol (CAS 72671-95-5) is a chemical compound with molecular formula C10H15N3O7 and molecular weight 289.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,5-dihydro-1,2-oxazole-3,5-dicarboxamide
Also Known As: 1,4-Anhydro-1-{3-carbamoyl-5-[hydroxy(imino)methyl]-4,5-dihydro-1,2-oxazol-4-yl}pentitol, 4-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,5-dihydro-1,2-oxazole-3,5-dicarboxamide
| Molecular Formula | C10H15N3O7 |
|---|---|
| Molecular Weight | 289.09 g/mol |
| LogP | -3.5 |
| Topological Polar Surface Area | 178.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.091 |
| Heavy Atoms | 20 |
| Complexity | 454.0 |
Chemical Identifiers
| CAS Number | 72671-95-5 |
|---|---|
| SMILES | C(C1C(C(C(O1)C2C(ON=C2C(=O)N)C(=O)N)O)O)O |
| InChIKey | FNKVTBLSYXYAJX-UHFFFAOYSA-N |
Product Overview
1,4-Anhydro-1-{3-carbamoyl-5-[hydroxy(imino)methyl]-4,5-dihydro-1,2-oxazol-4-yl}pentitol (CAS 72671-95-5), with molecular formula C10H15N3O7 and molecular weight 289.09 g/mol. IUPAC: 4-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,5-dihydro-1,2-oxazole-3,5-dicarboxamide.
Chemical Property Profile of 1,4-Anhydro-1-{3-carbamoyl-5-[hydroxy(imino)methyl]-4,5-dihydro-1,2-oxazol-4-yl}pentitol
Property Insights of 1,4-Anhydro-1-{3-carbamoyl-5-[hydroxy(imino)methyl]-4,5-dihydro-1,2-oxazol-4-yl}pentitol
The XLogP value of -3.5 indicates that 1,4-Anhydro-1-{3-carbamoyl-5-[hydroxy(imino)methyl]-4,5-dihydro-1,2-oxazol-4-yl}pentitol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 178.0 Ų indicates high polarity, suggesting 1,4-Anhydro-1-{3-carbamoyl-5-[hydroxy(imino)methyl]-4,5-dihydro-1,2-oxazol-4-yl}pentitol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,4-Anhydro-1-{3-carbamoyl-5-[hydroxy(imino)methyl]-4,5-dihydro-1,2-oxazol-4-yl}pentitol has 5 hydrogen bond donor(s) and 8 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 1,4-Anhydro-1-{3-carbamoyl-5-[hydroxy(imino)methyl]-4,5-dihydro-1,2-oxazol-4-yl}pentitol?
The CAS number of 1,4-Anhydro-1-{3-carbamoyl-5-[hydroxy(imino)methyl]-4,5-dihydro-1,2-oxazol-4-yl}pentitol is 72671-95-5.
What is the molecular formula of 1,4-Anhydro-1-{3-carbamoyl-5-[hydroxy(imino)methyl]-4,5-dihydro-1,2-oxazol-4-yl}pentitol?
The molecular formula of 1,4-Anhydro-1-{3-carbamoyl-5-[hydroxy(imino)methyl]-4,5-dihydro-1,2-oxazol-4-yl}pentitol is C10H15N3O7.
What is the molecular weight of 1,4-Anhydro-1-{3-carbamoyl-5-[hydroxy(imino)methyl]-4,5-dihydro-1,2-oxazol-4-yl}pentitol?
The molecular weight of 1,4-Anhydro-1-{3-carbamoyl-5-[hydroxy(imino)methyl]-4,5-dihydro-1,2-oxazol-4-yl}pentitol is 289.09 g/mol.
Where can I buy 1,4-Anhydro-1-{3-carbamoyl-5-[hydroxy(imino)methyl]-4,5-dihydro-1,2-oxazol-4-yl}pentitol?
You can request a quote for 1,4-Anhydro-1-{3-carbamoyl-5-[hydroxy(imino)methyl]-4,5-dihydro-1,2-oxazol-4-yl}pentitol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Anhydro-1-{3-carbamoyl-5-[hydroxy(imino)methyl]-4,5-dihydro-1,2-oxazol-4-yl}pentitol?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Anhydro-1-{3-carbamoyl-5-[hydroxy(imino)methyl]-4,5-dihydro-1,2-oxazol-4-yl}pentitol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.