6-Adad-1H-pbid
TL;DR: 6-Adad-1H-pbid (CAS 155474-51-4) is a chemical compound with molecular formula C15H17N3O4 and molecular weight 303.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-(aziridin-1-yl)-5,8-dihydroxy-7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-3-yl] acetate
Also Known As: 6-Adad-1H-pbid, 6-(1-Aziridinyl)-2,3-dihydro-3-acetoxy-5,8-dihydroxy-7-methyl-1H-pyrrolo(1,2-a)benzimidazole, 6-(1-Aziridinyl)-2,3-dihydro-7-methyl-1H-pyrrolo(1,2-a)benzimidazole-3,5,8-triol 3-acetate, [6-(aziridin-1-yl)-5,8-dihydroxy-7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-3-yl] acetate, 1H-Pyrrolo(1,2-a)benzimidazole-3,5,8-triol, 6-(1-aziridinyl)-2,3-dihydro-7-methyl-, 3-acetate
| Molecular Formula | C15H17N3O4 |
|---|---|
| Molecular Weight | 303.12 g/mol |
| LogP | 1.58382 |
| Topological Polar Surface Area | 87.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 303.12192 |
| Heavy Atoms | 22 |
| Complexity | 807.2009 |
Chemical Identifiers
| CAS Number | 155474-51-4 |
|---|---|
| SMILES | CC1=C(C(=C2C(=C1O)N3CCC(C3=N2)OC(=O)C)O)N4CC4 |
Product Overview
6-Adad-1H-pbid (CAS 155474-51-4), with molecular formula C15H17N3O4 and molecular weight 303.12 g/mol. IUPAC: [6-(aziridin-1-yl)-5,8-dihydroxy-7-methyl-2,3-dihydro-1H-pyrrolo[1,2-a]benzimidazol-3-yl] acetate.
Chemical Property Profile of 6-Adad-1H-pbid
Property Insights of 6-Adad-1H-pbid
The XLogP value of 1.58382 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Adad-1H-pbid. The TPSA of 87.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Adad-1H-pbid. Following Lipinski's Rule of Five, 6-Adad-1H-pbid has 2 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 6-Adad-1H-pbid?
The CAS number of 6-Adad-1H-pbid is 155474-51-4.
What is the molecular formula of 6-Adad-1H-pbid?
The molecular formula of 6-Adad-1H-pbid is C15H17N3O4.
What is the molecular weight of 6-Adad-1H-pbid?
The molecular weight of 6-Adad-1H-pbid is 303.12 g/mol.
Where can I buy 6-Adad-1H-pbid?
You can request a quote for 6-Adad-1H-pbid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Adad-1H-pbid?
Yes, KEHONG BIO provides custom synthesis services for 6-Adad-1H-pbid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.