CAS No.208260-29-1,ZM 336372 Suppliers

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Basic Information

Molecular Structure:
CAS No.:	208260-29-1
Name:	ZM 336372
Article Data:	1

Formula:	C₂₃H₂₃N₃O₃
Molecular Weight:	389.454
Synonyms:	N-[5-(3-DIMETHYLAMINOBENZAMIDO)-2-METHYLPHENYL]-4-HYDROXYBENZAMIDE;3-(DIMETHYLAMINO)-N-[3-[(4-HYDROXYBENZOYL)-AMINO]-4-METHYLPHENYL]BENZAMIDE;Zinc00581684;
Density:	1.298 g/cm³
Boiling Point:	484.4 °C at 760 mmHg
Flash Point:	246.8 °C
PSA:	81.67000
LogP:	4.41720

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Specification

The ZM 336372 is an organic compound with the formula C₂₃H₂₃N₃O₃. The systematic name of this chemical is 3-(dimethylamino)-N-{3-[(4-hydroxybenzoyl)amino]-4-methylphenyl}benzamide. With the CAS registry number 208260-29-1, it is also named as Benzamide, 3-(dimethylamino)-N-[3-[(4-hydroxybenzoyl)amino]-4-methylphenyl]-. In addition, this chemical should be stored at the temperature of -20 °C.

The other characteristics of ZM 336372 can be summarized as: (1)ACD/LogP: 3.98; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.97; (4)ACD/LogD (pH 7.4): 3.9; (5)ACD/BCF (pH 5.5): 606.32; (6)ACD/BCF (pH 7.4): 523.95; (7)ACD/KOC (pH 5.5): 3396.06; (8)ACD/KOC (pH 7.4): 2934.68; (9)#H bond acceptors: 6; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 53.09 Å²; (13)Index of Refraction: 1.704; (14)Molar Refractivity: 116.42 cm³; (15)Molar Volume: 299.8 cm³; (16)Polarizability: 46.15×10^-24 cm³; (17)Surface Tension: 61.9 dyne/cm; (18)Density: 1.298 g/cm³; (19)Flash Point: 246.8 °C; (20)Enthalpy of Vaporization: 77.83 kJ/mol; (21)Boiling Point: 484.4 °C at 760 mmHg; (22)Vapour Pressure: 5.21E-10 mmHg at 25°C.

People can use the following data to convert to the molecule structure.
1. SMILES:O=C(c1ccc(O)cc1)Nc3cc(NC(=O)c2cccc(N(C)C)c2)ccc3C
2. InChI:InChI=1/C23H23N3O3/c1-15-7-10-18(24-23(29)17-5-4-6-19(13-17)26(2)3)14-21(15)25-22(28)16-8-11-20(27)12-9-16/h4-14,27H,1-3H3,(H,24,29)(H,25,28)
3. InChIKey:PYEFPDQFAZNXLI-UHFFFAOYAE
4. Std. InChI:InChI=1S/C23H23N3O3/c1-15-7-10-18(24-23(29)17-5-4-6-19(13-17)26(2)3)14-21(15)25-22(28)16-8-11-20(27)12-9-16/h4-14,27H,1-3H3,(H,24,29)(H,25,28)
5. Std. InChIKey:PYEFPDQFAZNXLI-UHFFFAOYSA-N