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Urapidil hydrochloride

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Name

Urapidil hydrochloride

EINECS 636-348-0
CAS No. 64887-14-5 Density N/A
PSA 71.74000 LogP 1.59470
Solubility soluble in water Melting Point 156-158 °C
Formula C20H29N5O3.HCl Boiling Point 549 °C at 760 mmHg
Molecular Weight 423.94 Flash Point 285.8 °C
Transport Information N/A Appearance white to off-white crystalline powder
Safety 26-36 Risk Codes 22-36/37/38
Molecular Structure Molecular Structure of 64887-14-5 (Urapidil hydrochloride) Hazard Symbols HarmfulXn
Synonyms

2,4(1H,3H)-Pyrimidinedione,6-[[3-[4-(2-methoxyphenyl)-1-piperazinyl]propyl]amino]-1,3-dimethyl-,monohydrochloride (9CI);Urapidil hydrochloride;

 

Urapidil hydrochloride Specification

The Urapidil hydrochloride is an organic compound with the formula C20H29N5O3.HCl. The IUPAC name of this chemical is 6-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propylamino]-1,3-dimethylpyrimidine-2,4-dione hydrochloride. With the CAS registry number 64887-14-5, it is also named as 2,4(1H,3H)-Pyrimidinedione, 6-((3-(4-(2-methoxyphenyl)-1-piperazinyl)propyl)amino)-1,3-dimethyl-, monohydrochloride. The product's categories are Intermediates & Fine Chemicals; Pharmaceuticals; Adrenoceptor. Besides, it is a white to off-white crystalline powder.

Physical properties about Urapidil hydrochloride are: (1)ACD/LogP: 2.28; (2)ACD/LogD (pH 5.5): -0.92; (3)ACD/LogD (pH 7.4): 0.18; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 3.28; (8)#H bond acceptors: 8; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 7; (11)Polar Surface Area: 59.57 Å2; (12)Flash Point: 285.8 °C; (13)Enthalpy of Vaporization: 82.87 kJ/mol; (14)Boiling Point: 549 °C at 760 mmHg; (15)Vapour Pressure: 4.22E-12 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is harmful if swallowed. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides, this chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl.O=C1\C=C(/N(C(=O)N1C)C)NCCCN3CCN(c2ccccc2OC)CC3
(2)InChI: InChI=1/C20H29N5O3.ClH/c1-22-18(15-19(26)23(2)20(22)27)21-9-6-10-24-11-13-25(14-12-24)16-7-4-5-8-17(16)28-3;/h4-5,7-8,15,21H,6,9-14H2,1-3H3;1H
(3)InChIKey: KTMLZVUAXJERAT-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C20H29N5O3.ClH/c1-22-18(15-19(26)23(2)20(22)27)21-9-6-10-24-11-13-25(14-12-24)16-7-4-5-8-17(16)28-3;/h4-5,7-8,15,21H,6,9-14H2,1-3H3;1H CopyCopied
(5)Std. InChIKey: KTMLZVUAXJERAT-UHFFFAOYSA-N

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