3NH-D-arab-ddT deriv.
TL;DR: 3NH-D-arab-ddT deriv. (CAS 133488-28-5) is a chemical compound with molecular formula C10H14BrN3O5 and molecular weight 335.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2S,4R,5S)-4-amino-5-[(1R)-1,2-dihydroxyethyl]oxolan-2-yl]-5-bromopyrimidine-2,4-dione
Also Known As: 3NH-D-arab-ddT deriv., 3NH-D-arab-ddU deriv., 2,4(1H,3H)-Pyrimidinedione, 1-(3-amino-2,3-dideoxy-alpha-D-arabino-hexofuranosyl)-5-bromo-, 1-(3-Amino-2,3-dideoxy-alpha-D-arabino-hexofuranosyl)-5-bromouracil, 1-[(2S,4R,5S)-4-amino-5-[(1R)-1,2-dihydroxyethyl]oxolan-2-yl]-5-bromopyrimidine-2,4-dione
| Molecular Formula | C10H14BrN3O5 |
|---|---|
| Molecular Weight | 335.01 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 335.0117 |
| Heavy Atoms | 19 |
| Complexity | 429.0 |
Chemical Identifiers
| CAS Number | 133488-28-5 |
|---|---|
| SMILES | C1[C@H]([C@H](O[C@@H]1N2C=C(C(=O)NC2=O)Br)[C@@H](CO)O)N |
| InChIKey | NEWXDJSLWWVNAR-NGJRWZKOSA-N |
Product Overview
3NH-D-arab-ddT deriv. (CAS 133488-28-5), with molecular formula C10H14BrN3O5 and molecular weight 335.01 g/mol. IUPAC: 1-[(2S,4R,5S)-4-amino-5-[(1R)-1,2-dihydroxyethyl]oxolan-2-yl]-5-bromopyrimidine-2,4-dione.
Chemical Property Profile of 3NH-D-arab-ddT deriv.
Property Insights of 3NH-D-arab-ddT deriv.
The XLogP value of -1.2 indicates that 3NH-D-arab-ddT deriv. is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3NH-D-arab-ddT deriv.. Following Lipinski's Rule of Five, 3NH-D-arab-ddT deriv. has 4 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 3NH-D-arab-ddT deriv.?
The CAS number of 3NH-D-arab-ddT deriv. is 133488-28-5.
What is the molecular formula of 3NH-D-arab-ddT deriv.?
The molecular formula of 3NH-D-arab-ddT deriv. is C10H14BrN3O5.
What is the molecular weight of 3NH-D-arab-ddT deriv.?
The molecular weight of 3NH-D-arab-ddT deriv. is 335.01 g/mol.
Where can I buy 3NH-D-arab-ddT deriv.?
You can request a quote for 3NH-D-arab-ddT deriv. directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3NH-D-arab-ddT deriv.?
Yes, KEHONG BIO provides custom synthesis services for 3NH-D-arab-ddT deriv. and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.