TL;DR: BIM-0033336.P001 (CAS 1309677-66-4) is a chemical compound with molecular formula C17H18N6O and molecular weight 322.1542 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(E)-(3,5-dimethyl-1-phenylpyrazol-4-yl)methylideneamino]-5-methyl-1H-pyrazole-3-carboxamide
Also Known As: BIM-0033336.P001, N-[(E)-(3,5-dimethyl-1-phenylpyrazol-4-yl)methylideneamino]-5-methyl-1H-pyrazole-3-carboxamide, N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methylideneamino]-5-methyl-1H-pyrazole-3-carboxamide, N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyleneamino]-5-methyl-1H-pyrazole-3-carboxamide, N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methylideneamino]-5-methyl-1H-pyrazole-3-carboxamide
| Molecular Formula | C17H18N6O |
| Molecular Weight | 322.1542 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 88.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 322.1542 Da |
| Heavy Atoms | 24 |
| Complexity | 464.0 |
| SMILES | CC1=CC(=NN1)C(=O)N/N=C/C2=C(N(N=C2C)C3=CC=CC=C3)C |
| InChIKey | GQZKTKKWWAKNBL-VCHYOVAHSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BIM-0033336.P001. The TPSA of 88.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0033336.P001. Following Lipinski's Rule of Five, BIM-0033336.P001 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 BIM-0033336.P001 is 1309677-66-4.
The molecular formula of BIM-0033336.P001 is C17H18N6O.
The molecular weight of BIM-0033336.P001 is 322.1542 g/mol.
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