C16-H27-N3-O.Cl-H.1/2H2-O
TL;DR: C16-H27-N3-O.Cl-H.1/2H2-O (CAS 135420-41-6) is a chemical compound with molecular formula C16H28ClN3O and molecular weight 313.19208 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N'-[2-(diethylamino)ethyl]-4-propan-2-yloxybenzenecarboximidamide;hydrochloride
Also Known As: C16-H27-N3-O.Cl-H.1/2H2-O, Benzenecarboximidamide, N-(2-(diethylamino)ethyl)-4-(1-methylethoxy)-, hydrochloride, hydrate (2:2:1), N'-(2-diethylaminoethyl)-4-propan-2-yloxy-benzenecarboximidamide Hydrochloride, N'-(2-diethylaminoethyl)-4-propan-2-yloxybenzenecarboximidamide hydrochloride, N'-[2-(Diethylamino)ethyl]-4-[(propan-2-yl)oxy]benzene-1-carboximidamide--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C16H28ClN3O |
| Molecular Weight | 313.19208 g/mol |
| XLogP | 2.9427 |
| Topological Polar Surface Area (TPSA) | 50.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 313.19208 Da |
| Heavy Atoms | 21 |
| Complexity | 279.0 |
| SMILES | CCN(CC)CCN=C(C1=CC=C(C=C1)OC(C)C)N.Cl |
| InChIKey | KVVIOMLYIXIPEY-UHFFFAOYSA-N |
Chemical Property Profile of C16-H27-N3-O.Cl-H.1/2H2-O
Property Insights of C16-H27-N3-O.Cl-H.1/2H2-O
The XLogP value of 2.9427 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C16-H27-N3-O.Cl-H.1/2H2-O. With a topological polar surface area (TPSA) of 50.9 Ų, C16-H27-N3-O.Cl-H.1/2H2-O exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C16-H27-N3-O.Cl-H.1/2H2-O has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of C16-H27-N3-O.Cl-H.1/2H2-O?
The CAS number of C16-H27-N3-O.Cl-H.1/2H2-O is 135420-41-6.
What is the molecular formula of C16-H27-N3-O.Cl-H.1/2H2-O?
The molecular formula of C16-H27-N3-O.Cl-H.1/2H2-O is C16H28ClN3O.
What is the molecular weight of C16-H27-N3-O.Cl-H.1/2H2-O?
The molecular weight of C16-H27-N3-O.Cl-H.1/2H2-O is 313.19208 g/mol.
Where can I buy C16-H27-N3-O.Cl-H.1/2H2-O?
You can request a quote for C16-H27-N3-O.Cl-H.1/2H2-O directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C16-H27-N3-O.Cl-H.1/2H2-O?
Yes, CoreyChem provides custom synthesis services for C16-H27-N3-O.Cl-H.1/2H2-O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.