O-(D-Glucopyranosylidene)amino N-Phenylcarbamate
TL;DR: O-(D-Glucopyranosylidene)amino N-Phenylcarbamate (CAS 104012-84-2) is a chemical compound with molecular formula C13H16N2O7 and molecular weight 312.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-ylidene]amino] N-phenylcarbamate
Also Known As: Gluconophylurethane, O-(D-Glucopyranosylidene)amino N-Phenylcarbamate, (2Z)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-one O-(anilinocarbonyl)oxime, [[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-ylidene]amino] N-phenylcarbamate, [(3R,4S,5S,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YLIDENE]AMINO N-PHENYLCARBAMATE
| Molecular Formula | C13H16N2O7 |
|---|---|
| Molecular Weight | 312.10 g/mol |
| LogP | -0.9776 |
| Topological Polar Surface Area | 140.84 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.09576 |
| Heavy Atoms | 22 |
| Complexity | 534.44995 |
Chemical Identifiers
| CAS Number | 104012-84-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)ON=C2C(C(C(C(O2)CO)O)O)O |
Product Overview
O-(D-Glucopyranosylidene)amino N-Phenylcarbamate (CAS 104012-84-2), with molecular formula C13H16N2O7 and molecular weight 312.10 g/mol. IUPAC: [[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-ylidene]amino] N-phenylcarbamate.
Chemical Property Profile of O-(D-Glucopyranosylidene)amino N-Phenylcarbamate
Property Insights of O-(D-Glucopyranosylidene)amino N-Phenylcarbamate
The XLogP value of -0.9776 indicates that O-(D-Glucopyranosylidene)amino N-Phenylcarbamate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 140.84 Ų indicates high polarity, suggesting O-(D-Glucopyranosylidene)amino N-Phenylcarbamate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, O-(D-Glucopyranosylidene)amino N-Phenylcarbamate 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 O-(D-Glucopyranosylidene)amino N-Phenylcarbamate?
The CAS number of O-(D-Glucopyranosylidene)amino N-Phenylcarbamate is 104012-84-2.
What is the molecular formula of O-(D-Glucopyranosylidene)amino N-Phenylcarbamate?
The molecular formula of O-(D-Glucopyranosylidene)amino N-Phenylcarbamate is C13H16N2O7.
What is the molecular weight of O-(D-Glucopyranosylidene)amino N-Phenylcarbamate?
The molecular weight of O-(D-Glucopyranosylidene)amino N-Phenylcarbamate is 312.10 g/mol.
Where can I buy O-(D-Glucopyranosylidene)amino N-Phenylcarbamate?
You can request a quote for O-(D-Glucopyranosylidene)amino N-Phenylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-(D-Glucopyranosylidene)amino N-Phenylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for O-(D-Glucopyranosylidene)amino N-Phenylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.