TL;DR: 10-Phenothiazineethylamine, N,N-bis(2-chloroethyl)- (CAS 93947-04-7) is a chemical compound with molecular formula C18H20Cl2N2S and molecular weight 366.07242 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-bis(2-chloroethyl)-2-phenothiazin-10-ylethanamine
Also Known As: NCIOpen2_007398, 10-Phenothiazineethylamine, N,N-bis(2-chloroethyl)-, N,N-Bis(2-chloroethyl)-10-phenothiazineethylamine, Phenothiazine, 10-(2-(bis(2-chloroethyl)amino)ethyl)-, N-(2-(10-Phenothiazinyl)ethyl)-bis(2-chloroethyl)amine
| Molecular Formula | C18H20Cl2N2S |
| Molecular Weight | 366.07242 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 31.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 366.07242 Da |
| Heavy Atoms | 23 |
| Complexity | 330.0 |
| SMILES | C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CCN(CCCl)CCCl |
| InChIKey | UWBCGYAVYMFZRK-UHFFFAOYSA-N |
The XLogP value of 5.4 indicates that 10-Phenothiazineethylamine, N,N-bis(2-chloroethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.8 Ų, 10-Phenothiazineethylamine, N,N-bis(2-chloroethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 10-Phenothiazineethylamine, N,N-bis(2-chloroethyl)- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 10-Phenothiazineethylamine, N,N-bis(2-chloroethyl)- is 93947-04-7.
The molecular formula of 10-Phenothiazineethylamine, N,N-bis(2-chloroethyl)- is C18H20Cl2N2S.
The molecular weight of 10-Phenothiazineethylamine, N,N-bis(2-chloroethyl)- is 366.07242 g/mol.
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