TL;DR: alpha-Amino-5H-dibenzo[a,d]-cycloheptene-5-acetic acid, hydrochloride (CAS 147900-42-3) is a chemical compound with molecular formula C17H16ClNO2 and molecular weight 301.08694 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-2-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenyl)acetic acid;hydrochloride
Also Known As: alpha-Amino-5H-dibenzo[a,d]-cycloheptene-5-acetic acid, hydrochloride, alpha-Amino-5H-dibenzo[a,d]cycloheptene-5-acetic acid, hydrochloride, alpha-Amino-5H -dibenzo[a,d]-cycloheptene-5-acetic acid, hydrochloride
| Molecular Formula | C17H16ClNO2 |
| Molecular Weight | 301.08694 g/mol |
| XLogP | 3.136 |
| Topological Polar Surface Area (TPSA) | 63.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 301.08694 Da |
| Heavy Atoms | 21 |
| Complexity | 366.0 |
| SMILES | C1=CC=C2C(C3=CC=CC=C3C=CC2=C1)C(C(=O)O)N.Cl |
| InChIKey | YIDHVWVZBWNFQT-UHFFFAOYSA-N |
The XLogP value of 3.136 indicates that alpha-Amino-5H-dibenzo[a,d]-cycloheptene-5-acetic acid, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for alpha-Amino-5H-dibenzo[a,d]-cycloheptene-5-acetic acid, hydrochloride. Following Lipinski's Rule of Five, alpha-Amino-5H-dibenzo[a,d]-cycloheptene-5-acetic acid, hydrochloride has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of alpha-Amino-5H-dibenzo[a,d]-cycloheptene-5-acetic acid, hydrochloride is 147900-42-3.
The molecular formula of alpha-Amino-5H-dibenzo[a,d]-cycloheptene-5-acetic acid, hydrochloride is C17H16ClNO2.
The molecular weight of alpha-Amino-5H-dibenzo[a,d]-cycloheptene-5-acetic acid, hydrochloride is 301.08694 g/mol.
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