TL;DR: BAS 01176549 (CAS 134068-17-0) is a chemical compound with molecular formula C21H25N3O3 and molecular weight 367.1896 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl N-[11-[2-(ethylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate
Also Known As: BAS 01176549, 3-Carbethoxyamino-5-monoethylaminoacetyl-10,11-dihydro-5H-dibenz(b,f)azepine, Carbamic acid, (5-((ethylamino)acetyl)-10,11-dihydro-5H-dibenz(b,f)azepin-3-yl)-, ethyl ester, Ethyl (5-((ethylamino)acetyl)-10,11-dihydro-5H-dibenz(b,f)azepin-3-yl)carbamate, ethyl [5-(N-ethylglycyl)-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl]carbamate
| Molecular Formula | C21H25N3O3 |
| Molecular Weight | 367.1896 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 70.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 367.1896 Da |
| Heavy Atoms | 27 |
| Complexity | 513.0 |
| SMILES | CCNCC(=O)N1C2=CC=CC=C2CCC3=C1C=C(C=C3)NC(=O)OCC |
| InChIKey | BHVLAOZBEMMGPS-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that BAS 01176549 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.7 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01176549. Following Lipinski's Rule of Five, BAS 01176549 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of BAS 01176549 is 134068-17-0.
The molecular formula of BAS 01176549 is C21H25N3O3.
The molecular weight of BAS 01176549 is 367.1896 g/mol.
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