![1,1'-((5-isobutyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)azanediyl)bis(propan-2-ol) structure](/static/products/896/896808-77-8.png)
1,1'-((5-isobutyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)azanediyl)bis(propan-2-ol)
TL;DR: 1,1'-((5-isobutyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)azanediyl)bis(propan-2-ol) (CAS 896808-77-8) is a chemical compound with molecular formula C24H34N4O4 and molecular weight 442.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[4,4-dimethyl-8-(2-methylpropyl)-5,11-dioxa-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-yl]-(2-hydroxypropyl)amino]propan-2-ol
Also Known As: 1,1'-((5-isobutyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)azanediyl)bis(propan-2-ol), 1,1'-{[2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl]imino}dipropan-2-ol
| Molecular Formula | C24H34N4O4 |
|---|---|
| Molecular Weight | 442.26 g/mol |
| LogP | 3.3888 |
| Topological Polar Surface Area | 104.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 442.258 |
| Heavy Atoms | 32 |
| Complexity | 1110.3231 |
Chemical Identifiers
| CAS Number | 896808-77-8 |
|---|---|
| SMILES | CC(C)CC1=NC2=C(C3=C1COC(C3)(C)C)C4=C(O2)C(=NC=N4)N(CC(C)O)CC(C)O |
Product Overview
1,1'-((5-isobutyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)azanediyl)bis(propan-2-ol) (CAS 896808-77-8), with molecular formula C24H34N4O4 and molecular weight 442.26 g/mol. IUPAC: 1-[[4,4-dimethyl-8-(2-methylpropyl)-5,11-dioxa-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-yl]-(2-hydroxypropyl)amino]propan-2-ol.
Chemical Property Profile of 1,1'-((5-isobutyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)azanediyl)bis(propan-2-ol)
Property Insights of 1,1'-((5-isobutyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)azanediyl)bis(propan-2-ol)
The XLogP value of 3.3888 indicates that 1,1'-((5-isobutyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)azanediyl)bis(propan-2-ol) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1'-((5-isobutyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)azanediyl)bis(propan-2-ol). Following Lipinski's Rule of Five, 1,1'-((5-isobutyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)azanediyl)bis(propan-2-ol) 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 1,1'-((5-isobutyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)azanediyl)bis(propan-2-ol)?
The CAS number of 1,1'-((5-isobutyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)azanediyl)bis(propan-2-ol) is 896808-77-8.
What is the molecular formula of 1,1'-((5-isobutyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)azanediyl)bis(propan-2-ol)?
The molecular formula of 1,1'-((5-isobutyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)azanediyl)bis(propan-2-ol) is C24H34N4O4.
What is the molecular weight of 1,1'-((5-isobutyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)azanediyl)bis(propan-2-ol)?
The molecular weight of 1,1'-((5-isobutyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)azanediyl)bis(propan-2-ol) is 442.26 g/mol.
Where can I buy 1,1'-((5-isobutyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)azanediyl)bis(propan-2-ol)?
You can request a quote for 1,1'-((5-isobutyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)azanediyl)bis(propan-2-ol) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-((5-isobutyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)azanediyl)bis(propan-2-ol)?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-((5-isobutyl-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]furo[3,2-d]pyrimidin-8-yl)azanediyl)bis(propan-2-ol) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.