5-amino-9-pentofuranosyl-1H-pyrrolo[2,3-d:5,4-d']dipyrimidine-2,4(3H,9H)-dithione
TL;DR: 5-amino-9-pentofuranosyl-1H-pyrrolo[2,3-d:5,4-d']dipyrimidine-2,4(3H,9H)-dithione (CAS 73851-49-7) is a chemical compound with molecular formula C13H14N6O4S2 and molecular weight 382.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,6,8,10,12-pentazatricyclo[7.4.0.02,7]trideca-1(13),2(7),9,11-tetraene-3,5-dithione
Also Known As: 5-amino-9-pentofuranosyl-1H-pyrrolo[2,3-d:5,4-d']dipyrimidine-2,4(3H,9H)-dithione, 13-Amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,6,8,10,12-pentazatricyclo[7.4.0.02,7]trideca-1(13),2(7),9,11-tetraene-3,5-dithione
| Molecular Formula | C13H14N6O4S2 |
|---|---|
| Molecular Weight | 382.05 g/mol |
| LogP | -0.10662 |
| Topological Polar Surface Area | 158.23 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 382.0518 |
| Heavy Atoms | 25 |
| Complexity | 1091.7333 |
Chemical Identifiers
| CAS Number | 73851-49-7 |
|---|---|
| SMILES | C1=NC(=C2C3=C(NC(=S)NC3=S)N(C2=N1)C4C(C(C(O4)CO)O)O)N |
Product Overview
5-amino-9-pentofuranosyl-1H-pyrrolo[2,3-d:5,4-d']dipyrimidine-2,4(3H,9H)-dithione (CAS 73851-49-7), with molecular formula C13H14N6O4S2 and molecular weight 382.05 g/mol. IUPAC: 13-amino-8-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,6,8,10,12-pentazatricyclo[7.4.0.02,7]trideca-1(13),2(7),9,11-tetraene-3,5-dithione.
Chemical Property Profile of 5-amino-9-pentofuranosyl-1H-pyrrolo[2,3-d:5,4-d']dipyrimidine-2,4(3H,9H)-dithione
Property Insights of 5-amino-9-pentofuranosyl-1H-pyrrolo[2,3-d:5,4-d']dipyrimidine-2,4(3H,9H)-dithione
The XLogP value of -0.10662 indicates that 5-amino-9-pentofuranosyl-1H-pyrrolo[2,3-d:5,4-d']dipyrimidine-2,4(3H,9H)-dithione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 158.23 Ų indicates high polarity, suggesting 5-amino-9-pentofuranosyl-1H-pyrrolo[2,3-d:5,4-d']dipyrimidine-2,4(3H,9H)-dithione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-amino-9-pentofuranosyl-1H-pyrrolo[2,3-d:5,4-d']dipyrimidine-2,4(3H,9H)-dithione has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-amino-9-pentofuranosyl-1H-pyrrolo[2,3-d:5,4-d']dipyrimidine-2,4(3H,9H)-dithione?
The CAS number of 5-amino-9-pentofuranosyl-1H-pyrrolo[2,3-d:5,4-d']dipyrimidine-2,4(3H,9H)-dithione is 73851-49-7.
What is the molecular formula of 5-amino-9-pentofuranosyl-1H-pyrrolo[2,3-d:5,4-d']dipyrimidine-2,4(3H,9H)-dithione?
The molecular formula of 5-amino-9-pentofuranosyl-1H-pyrrolo[2,3-d:5,4-d']dipyrimidine-2,4(3H,9H)-dithione is C13H14N6O4S2.
What is the molecular weight of 5-amino-9-pentofuranosyl-1H-pyrrolo[2,3-d:5,4-d']dipyrimidine-2,4(3H,9H)-dithione?
The molecular weight of 5-amino-9-pentofuranosyl-1H-pyrrolo[2,3-d:5,4-d']dipyrimidine-2,4(3H,9H)-dithione is 382.05 g/mol.
Where can I buy 5-amino-9-pentofuranosyl-1H-pyrrolo[2,3-d:5,4-d']dipyrimidine-2,4(3H,9H)-dithione?
You can request a quote for 5-amino-9-pentofuranosyl-1H-pyrrolo[2,3-d:5,4-d']dipyrimidine-2,4(3H,9H)-dithione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-amino-9-pentofuranosyl-1H-pyrrolo[2,3-d:5,4-d']dipyrimidine-2,4(3H,9H)-dithione?
Yes, KEHONG BIO provides custom synthesis services for 5-amino-9-pentofuranosyl-1H-pyrrolo[2,3-d:5,4-d']dipyrimidine-2,4(3H,9H)-dithione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.