TL;DR: 9-Chloro-2,5-bis(4-methoxyphenyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine (CAS 303061-21-4) is a chemical compound with molecular formula C24H21ClN2O3 and molecular weight 420.12408 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
9-chloro-2,5-bis(4-methoxyphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
Also Known As: MixCom6_000085, 9-chloro-2,5-bis(4-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine, 9-Chloro-2,5-bis(4-methoxyphenyl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine, 9-CHLORO-2,5-BIS(4-METHOXYPHENYL)-1,10B-DIHYDROPYRAZOLO(1,5-C)(1,3)BENZOXAZINE, 9-chloro-2,5-bis(4-methoxyphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
| Molecular Formula | C24H21ClN2O3 |
| Molecular Weight | 420.12408 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 43.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 420.12408 Da |
| Heavy Atoms | 30 |
| Complexity | 616.0 |
| SMILES | COC1=CC=C(C=C1)C2N3C(CC(=N3)C4=CC=C(C=C4)OC)C5=C(O2)C=CC(=C5)Cl |
| InChIKey | UHOWCOKHCPMTAJ-UHFFFAOYSA-N |
The XLogP value of 5.4 indicates that 9-Chloro-2,5-bis(4-methoxyphenyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.3 Ų, 9-Chloro-2,5-bis(4-methoxyphenyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Chloro-2,5-bis(4-methoxyphenyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 9-Chloro-2,5-bis(4-methoxyphenyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine is 303061-21-4.
The molecular formula of 9-Chloro-2,5-bis(4-methoxyphenyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine is C24H21ClN2O3.
The molecular weight of 9-Chloro-2,5-bis(4-methoxyphenyl)-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine is 420.12408 g/mol.
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