(S)-Tamsulosin Hydrochloride
PubChem CID: 60146
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| Compound Synonyms | (S)-Tamsulosin Hydrochloride, 106463-19-8, 5-[(2S)-2-[2-(2-ethoxyphenoxy)ethylamino]propyl]-2-methoxybenzenesulfonamide, hydrochloride, ent-tamsulosin hydrochloride, (+)-LY 253352, SCHEMBL9300408, DTXSID00275650, CHEBI:142550, 5-[(2S)-2-[[2-(-Ethoxyphenoxy)ethyl]amino]propyl]-2-methoxybenzenesulfonamide Hydrochloride, (+)-(S)-5-(2-((2-(o-ethoxyphenoxy)ethyl)amino)propyl)-2-methoxybenzenesulfonamide monohydrochloride, (S)-5-(2-((2-(2-ethoxyphenoxy)ethyl)amino)propyl)-2-methoxybenzenesulfonamide monohydrochloride, 5-[(2S)-2-{[2-(2-ethoxyphenoxy)ethyl]amino}propyl]-2-methoxybenzenesulfonamide hydrochloride, S-(+)-5-(2-((2-(2-ethoxyphenoxy)ethyl)amino)propyl)-2-methoxybenzenesulfonamide hydrochloride |
|---|---|
| Topological Polar Surface Area | 108.0 |
| Hydrogen Bond Donor Count | 3.0 |
| Heavy Atom Count | 29.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 539.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 1.0 |
| Iupac Name | 5-[(2S)-2-[2-(2-ethoxyphenoxy)ethylamino]propyl]-2-methoxybenzenesulfonamide, hydrochloride |
| Nih Violation | False |
| Prediction Hob | 1.0 |
| Is Pains | False |
| Molecular Formula | C20H29ClN2O5S |
| Prediction Swissadme | 0.0 |
| Inchi Key | ZZIZZTHXZRDOFM-RSAXXLAASA-N |
| Fcsp3 | 0.4 |
| Rotatable Bond Count | 11.0 |
| Compound Name | (S)-Tamsulosin Hydrochloride |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 444.149 |
| Formal Charge | 0.0 |
| Brenk Violation | True |
| Monoisotopic Mass | 444.149 |
| Hydrogen Bond Acceptor Count | 7.0 |
| Molecular Weight | 445.0 |
| Covalent Unit Count | 2.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -4.402989096551725 |
| Inchi | InChI=1S/C20H28N2O5S.ClH/c1-4-26-17-7-5-6-8-18(17)27-12-11-22-15(2)13-16-9-10-19(25-3)20(14-16)28(21,23)24, /h5-10,14-15,22H,4,11-13H2,1-3H3,(H2,21,23,24), 1H/t15-, /m0./s1 |
| Smiles | CCOC1=CC=CC=C1OCCN[C@@H](C)CC2=CC(=C(C=C2)OC)S(=O)(=O)N.Cl |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Asarum Heterotropoides (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Asarum Sieboldii (Plant) Rel Props:Source_db:cmaup_ingredients