7,8-Dihydro-7-methyl-8-thioxoguanosine
TL;DR: 7,8-Dihydro-7-methyl-8-thioxoguanosine (CAS 127786-83-8) is a chemical compound with molecular formula C20H28N4O6 and molecular weight 420.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butan-2-yl N-[2,5-bis(aziridin-1-yl)-4-(butan-2-yloxycarbonylamino)-3,6-dioxocyclohexa-1,4-dien-1-yl]carbamate
Also Known As: 7,8-Dihydro-7-methyl-8-thioxoguanosine, butan-2-yl N-[2,5-bis(aziridin-1-yl)-4-(butan-2-yloxycarbonylamino)-3,6-dioxocyclohexa-1,4-dien-1-yl]carbamate, (2,5-Bis(1-aziridinyl)-3,6-dioxo-1,4-cyclohexadiene-1,4-diyl)biscarbamic acid, bis(1-methylpropyl) ester, Carbamic acid,N,N'-[2,5-bis(1-aziridinyl)-3,6-dioxo-1,4-cyclohexadiene-1,4-diyl]bis-,C,C'-bis(1-methylpropyl) ester, (+/-)-3-Amino-9,13b-dihydro-1H-dibenz[c,f]imidazo[1,5-a]azepine hydrobromide
| Molecular Formula | C20H28N4O6 |
|---|---|
| Molecular Weight | 420.20 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 420.2009 |
| Heavy Atoms | 30 |
| Complexity | 757.0 |
Chemical Identifiers
| CAS Number | 127786-83-8 |
|---|---|
| SMILES | CCC(C)OC(=O)NC1=C(C(=O)C(=C(C1=O)N2CC2)NC(=O)OC(C)CC)N3CC3 |
| InChIKey | NDTYNPXZXAMKER-UHFFFAOYSA-N |
Product Overview
7,8-Dihydro-7-methyl-8-thioxoguanosine (CAS 127786-83-8), with molecular formula C20H28N4O6 and molecular weight 420.20 g/mol. IUPAC: butan-2-yl N-[2,5-bis(aziridin-1-yl)-4-(butan-2-yloxycarbonylamino)-3,6-dioxocyclohexa-1,4-dien-1-yl]carbamate.
Chemical Property Profile of 7,8-Dihydro-7-methyl-8-thioxoguanosine
Property Insights of 7,8-Dihydro-7-methyl-8-thioxoguanosine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7,8-Dihydro-7-methyl-8-thioxoguanosine. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 7,8-Dihydro-7-methyl-8-thioxoguanosine. Following Lipinski's Rule of Five, 7,8-Dihydro-7-methyl-8-thioxoguanosine has 2 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 7,8-Dihydro-7-methyl-8-thioxoguanosine?
The CAS number of 7,8-Dihydro-7-methyl-8-thioxoguanosine is 127786-83-8.
What is the molecular formula of 7,8-Dihydro-7-methyl-8-thioxoguanosine?
The molecular formula of 7,8-Dihydro-7-methyl-8-thioxoguanosine is C20H28N4O6.
What is the molecular weight of 7,8-Dihydro-7-methyl-8-thioxoguanosine?
The molecular weight of 7,8-Dihydro-7-methyl-8-thioxoguanosine is 420.20 g/mol.
Where can I buy 7,8-Dihydro-7-methyl-8-thioxoguanosine?
You can request a quote for 7,8-Dihydro-7-methyl-8-thioxoguanosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7,8-Dihydro-7-methyl-8-thioxoguanosine?
Yes, KEHONG BIO provides custom synthesis services for 7,8-Dihydro-7-methyl-8-thioxoguanosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.