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Name |
Alfuzosin |
EINECS | N/A |
CAS No. | 81403-80-7 | Density | 1.272 g/cm3 |
PSA | 111.83000 | LogP | 2.32280 |
Solubility | N/A | Melting Point |
178-180 °C |
Formula | C19H27N5O4 | Boiling Point | N/A |
Molecular Weight | 389.454 | Flash Point | N/A |
Transport Information | N/A | Appearance | White Crystaline Powder |
Safety | Risk Codes | R20/21/22 | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
N-[3-[N-(4-Amino-6,7-dimethoxyquinazolin-2-yl)-N-(methyl)amino]propyl]tetrahydrofuran-2-carboxamide;SL 77499;Alfuzosinum; |
Article Data | 14 |
The IUPAC name of Alfuzosin is N-[3-[(4-amino-6,7-dimethoxyquinazolin-2-yl)-methylamino]propyl]oxolane-2-carboxamide. With the CAS registry number 81403-80-7, it is also named as 2-Furancarboxamide,N-[3-[(4-amino-6,7-dimethoxy-2-quinazolinyl) methylamino]propyl]tetrahydro-. The product's categories are APIs; Adrenoceptor, and the other registry numbers are 128707-53-9; 86163-78-2. In addition, its molecular formula is C19H27N5O4 and molecular weight is 389.45.
The other characteristics of Alfuzosin can be summarized as: (1)ACD/LogP: -1.00; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.43; (4)ACD/LogD (pH 7.4): -2.33; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 9; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 80.26 Å2; (13)Index of Refraction: 1.62; (14)Molar Refractivity: 107.62 cm3; (15)Molar Volume: 306 cm3; (16)Polarizability: 42.66×10-24cm3; (17)Surface Tension: 60.6 dyne/cm; (18)Density: 1.272 g/cm3.
Uses of this chemical: it is an α1 receptor antagonist which is used to treat benign prostatic hyperplasia (BPH). It works by relaxing the muscles in the prostate and bladder neck, making it easier to urinate. Moreover, it should be used with caution in patients with severe renal insufficiency.
People can use the following data to convert to the molecule structure.
(1)SMILES: O=C(NCCCN(c2nc1cc(OC)c(OC)cc1c(n2)N)C)C3OCCC3
(2)InChI: InChI=1/C19H27N5O4/c1-24(8-5-7-21-18(25)14-6-4-9-28-14)19-22-13-11-16(27-3)15(26-2)10-12(13)17(20)23-19/h10-11,14H,4-9H2,1-3H3,(H,21,25)(H2,20,22,23)
(3)InChIKey: WNMJYKCGWZFFKR-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C19H27N5O4/c1-24(8-5-7-21-18(25)14-6-4-9-28-14)19-22-13-11-16(27-3)15(26-2)10-12(13)17(20)23-19/h10-11,14H,4-9H2,1-3H3,(H,21,25)(H2,20,22,23)
(5)Std. InChIKey: WNMJYKCGWZFFKR-UHFFFAOYSA-N