J3.319.678D
TL;DR: J3.319.678D (CAS 705285-08-1) is a chemical compound with molecular formula C18H29N5O and molecular weight 331.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[(dimethylamino)methyl]-1-[3-(dimethylamino)propyl]-8,9-dihydro-7H-pyrano[3,2-e]benzimidazol-2-amine
Also Known As: J3.319.678D, 8-((dimethylamino)methyl)-1-(3-(dimethylamino)propyl)-1,7,8,9-tetrahydrochromeno[5,6-d]imidazol-2-amine, 1-[3-(Dimethylamino)propyl]-8-[(dimethylamino)methyl]-1,7,8,9-tetrahydropyrano[3,2-e]benzoimidazole-2-amine, 12-[(dimethylamino)methyl]-3-[3-(dimethylamino)propyl]-10-oxa-3,5-diazatricyclo[7.4.0.02,6]trideca-1,4,6,8-tetraen-4-amine, 8-(dimethylaminomethyl)-1-[3-(dimethylamino)propyl]-8,9-dihydro-7H-pyrano[3,2-e]benzimidazol-2-amine
| Molecular Formula | C18H29N5O |
|---|---|
| Molecular Weight | 331.24 g/mol |
| LogP | 1.6829 |
| Topological Polar Surface Area | 59.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 331.2372 |
| Heavy Atoms | 24 |
| Complexity | 706.9873 |
Chemical Identifiers
| CAS Number | 705285-08-1 |
|---|---|
| SMILES | CN(C)CCCN1C2=C(C=CC3=C2CC(CO3)CN(C)C)N=C1N |
Product Overview
J3.319.678D (CAS 705285-08-1), with molecular formula C18H29N5O and molecular weight 331.24 g/mol. IUPAC: 8-[(dimethylamino)methyl]-1-[3-(dimethylamino)propyl]-8,9-dihydro-7H-pyrano[3,2-e]benzimidazol-2-amine.
Chemical Property Profile of J3.319.678D
Property Insights of J3.319.678D
The XLogP value of 1.6829 suggests moderate lipophilicity, balancing water solubility and membrane permeability for J3.319.678D. With a topological polar surface area (TPSA) of 59.55 Ų, J3.319.678D exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, J3.319.678D has 1 hydrogen bond donor(s) and 5 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 J3.319.678D?
The CAS number of J3.319.678D is 705285-08-1.
What is the molecular formula of J3.319.678D?
The molecular formula of J3.319.678D is C18H29N5O.
What is the molecular weight of J3.319.678D?
The molecular weight of J3.319.678D is 331.24 g/mol.
Where can I buy J3.319.678D?
You can request a quote for J3.319.678D directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J3.319.678D?
Yes, KEHONG BIO provides custom synthesis services for J3.319.678D and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.