Thiourea, N-(1,1-dimethyl-3-oxobutyl)-N'-beta-D-ribofuranosyl-
TL;DR: Thiourea, N-(1,1-dimethyl-3-oxobutyl)-N'-beta-D-ribofuranosyl- (CAS 100551-67-5) is a chemical compound with molecular formula C12H22N2O5S and molecular weight 306.12494 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-(2-methyl-4-oxopentan-2-yl)thiourea
Also Known As: N'-(D-Ribosyl)-N-(2-methyl-4-oxo-2-pentyl)thiourea, N-(1,1-Dimethyl-3-oxobutyl)-N'-beta-D-ribofuranosylthiourea, Thiourea, N-(1,1-dimethyl-3-oxobutyl)-N'-beta-D-ribofuranosyl-, N1-(D-Ribosyl)-N3-(2-methyl-4-oxopentyl-2)thiourea, 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3-(2-methyl-4-oxopentan-2-yl)thiourea
Technical Specifications
| Molecular Formula | C12H22N2O5S |
| Molecular Weight | 306.12494 g/mol |
| XLogP | -1.3 |
| Topological Polar Surface Area (TPSA) | 143.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 306.12494 Da |
| Heavy Atoms | 20 |
| Complexity | 377.0 |
| SMILES | CC(=O)CC(C)(C)NC(=S)N[C@H]1[C@@H]([C@@H]([C@H](O1)CO)O)O |
| InChIKey | QFZOUJAPJJFFPY-ZYUZMQFOSA-N |
Chemical Property Profile of Thiourea, N-(1,1-dimethyl-3-oxobutyl)-N'-beta-D-ribofuranosyl-
Property Insights of Thiourea, N-(1,1-dimethyl-3-oxobutyl)-N'-beta-D-ribofuranosyl-
The XLogP value of -1.3 indicates that Thiourea, N-(1,1-dimethyl-3-oxobutyl)-N'-beta-D-ribofuranosyl- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 143.0 Ų indicates high polarity, suggesting Thiourea, N-(1,1-dimethyl-3-oxobutyl)-N'-beta-D-ribofuranosyl- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Thiourea, N-(1,1-dimethyl-3-oxobutyl)-N'-beta-D-ribofuranosyl- has 5 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Thiourea, N-(1,1-dimethyl-3-oxobutyl)-N'-beta-D-ribofuranosyl-?
The CAS number of Thiourea, N-(1,1-dimethyl-3-oxobutyl)-N'-beta-D-ribofuranosyl- is 100551-67-5.
What is the molecular formula of Thiourea, N-(1,1-dimethyl-3-oxobutyl)-N'-beta-D-ribofuranosyl-?
The molecular formula of Thiourea, N-(1,1-dimethyl-3-oxobutyl)-N'-beta-D-ribofuranosyl- is C12H22N2O5S.
What is the molecular weight of Thiourea, N-(1,1-dimethyl-3-oxobutyl)-N'-beta-D-ribofuranosyl-?
The molecular weight of Thiourea, N-(1,1-dimethyl-3-oxobutyl)-N'-beta-D-ribofuranosyl- is 306.12494 g/mol.
Where can I buy Thiourea, N-(1,1-dimethyl-3-oxobutyl)-N'-beta-D-ribofuranosyl-?
You can request a quote for Thiourea, N-(1,1-dimethyl-3-oxobutyl)-N'-beta-D-ribofuranosyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Thiourea, N-(1,1-dimethyl-3-oxobutyl)-N'-beta-D-ribofuranosyl-?
Yes, CoreyChem provides custom synthesis services for Thiourea, N-(1,1-dimethyl-3-oxobutyl)-N'-beta-D-ribofuranosyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.