TL;DR: DP 110095 (CAS 109210-66-4) is a chemical compound with molecular formula C22H29Cl2N5O3 and molecular weight 481.16473 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
14-[2-(2-hydroxyethylamino)ethyl]-10-[2-(2-hydroxyethylamino)ethylamino]-14,15-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),2,4,6,9,11,13(16)-heptaen-8-one;dihydrochloride
Also Known As: DP 110095, 2-(2-((2-Hydroxyethyl)amino)ethyl)-5-(2-((2-hydroxyethyl)aminoethyl)amino)anthra(1,9-cd)pyrazol-6(2H)one, 14-[2-(2-Hydroxyethylamino)ethyl]-10-[2-(2-hydroxyethylamino)ethylamino]-14,15-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),2,4,6,9,11,13(16)-heptaen-8-one;dihydrochloride, Anthra(1,9-cd)pyrazol-6(2H)-one, 2-(2-((2-hydroxyethyl)amino)ethyl)-5-((2-((2-hydroxyethyl)amino)ethyl)amino)-, dihydrochloride, 2-{2-[(2-Hydroxyethyl)amino]ethyl}-5-({2-[(2-hydroxyethyl)amino]ethyl}amino)dibenzo[cd,g]indazol-6(2H)-one--hydrogen chloride (1/2)
| Molecular Formula | C22H29Cl2N5O3 |
| Molecular Weight | 481.16473 g/mol |
| XLogP | 1.667 |
| Topological Polar Surface Area (TPSA) | 111.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 481.16473 Da |
| Heavy Atoms | 32 |
| Complexity | 565.0 |
| SMILES | C1=CC=C2C(=C1)C3=NN(C4=C3C(=C(C=C4)NCCNCCO)C2=O)CCNCCO.Cl.Cl |
| InChIKey | NCUOEABZPSJXDI-UHFFFAOYSA-N |
The XLogP value of 1.667 suggests moderate lipophilicity, balancing water solubility and membrane permeability for DP 110095. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for DP 110095. Following Lipinski's Rule of Five, DP 110095 has 7 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of DP 110095 is 109210-66-4.
The molecular formula of DP 110095 is C22H29Cl2N5O3.
The molecular weight of DP 110095 is 481.16473 g/mol.
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