3'-(5-Me-1,3,5-dithiazin)-Ara-T
TL;DR: 3'-(5-Me-1,3,5-dithiazin)-Ara-T (CAS 130468-30-3) is a chemical compound with molecular formula C14H21N3O5S2 and molecular weight 375.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2R,3S,4S,5S)-3-hydroxy-5-(hydroxymethyl)-4-(5-methyl-1,3,5-dithiazinan-2-yl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Also Known As: 3'-(5-Me-1,3,5-dithiazin)-Ara-T, 1-(3-Deoxy-3-C-(4,5-dihydro-5-methyl-1,3,5-dithiazin-2-yl)-beta-D-arabino-pentofuranosyl)thymine, 2,4(1H,3H)-Pyrimidinedione, 1-(3-deoxy-3-(dihydro-5-methyl-4H-1,3,5-dithiazin-2-yl)-beta-D-arabinofuranosyl)-5-methyl-, 1-[(2R,3S,4S,5S)-3-hydroxy-5-(hydroxymethyl)-4-(5-methyl-1,3,5-dithiazinan-2-yl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione, 1-[(2R,3S,4S,5S)-3-hydroxy-5-(hydroxymethyl)-4-(5-methyl-1,3,5-dithiazinan-2-yl)tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione
| Molecular Formula | C14H21N3O5S2 |
|---|---|
| Molecular Weight | 375.09 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 153.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 375.09225 |
| Heavy Atoms | 24 |
| Complexity | 553.0 |
Chemical Identifiers
| CAS Number | 130468-30-3 |
|---|---|
| SMILES | CC1=CN(C(=O)NC1=O)[C@H]2[C@H]([C@@H]([C@H](O2)CO)C3SCN(CS3)C)O |
| InChIKey | PXOXRQIUIYRJIA-MWGHHZFTSA-N |
Product Overview
3'-(5-Me-1,3,5-dithiazin)-Ara-T (CAS 130468-30-3), with molecular formula C14H21N3O5S2 and molecular weight 375.09 g/mol. IUPAC: 1-[(2R,3S,4S,5S)-3-hydroxy-5-(hydroxymethyl)-4-(5-methyl-1,3,5-dithiazinan-2-yl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione.
Chemical Property Profile of 3'-(5-Me-1,3,5-dithiazin)-Ara-T
Property Insights of 3'-(5-Me-1,3,5-dithiazin)-Ara-T
The XLogP value of -0.1 indicates that 3'-(5-Me-1,3,5-dithiazin)-Ara-T is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 153.0 Ų indicates high polarity, suggesting 3'-(5-Me-1,3,5-dithiazin)-Ara-T may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3'-(5-Me-1,3,5-dithiazin)-Ara-T has 3 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 3'-(5-Me-1,3,5-dithiazin)-Ara-T?
The CAS number of 3'-(5-Me-1,3,5-dithiazin)-Ara-T is 130468-30-3.
What is the molecular formula of 3'-(5-Me-1,3,5-dithiazin)-Ara-T?
The molecular formula of 3'-(5-Me-1,3,5-dithiazin)-Ara-T is C14H21N3O5S2.
What is the molecular weight of 3'-(5-Me-1,3,5-dithiazin)-Ara-T?
The molecular weight of 3'-(5-Me-1,3,5-dithiazin)-Ara-T is 375.09 g/mol.
Where can I buy 3'-(5-Me-1,3,5-dithiazin)-Ara-T?
You can request a quote for 3'-(5-Me-1,3,5-dithiazin)-Ara-T directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3'-(5-Me-1,3,5-dithiazin)-Ara-T?
Yes, KEHONG BIO provides custom synthesis services for 3'-(5-Me-1,3,5-dithiazin)-Ara-T and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.