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| CAS No.: | 2002-44-0 |
|---|---|
| Name: | H-PRO-LEU-GLY-NH2 |
| Molecular Structure: | |
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| Formula: | C13H24N4O3 |
| Molecular Weight: | 284.359 |
| Synonyms: | 2-Pyrrolidinecarboxamide,N-[1-[(carbamoylmethyl)carbamoyl]-3-methylbutyl]- (6CI,7CI);26: PN: US6093797PAGE: 15 claimed protein;27: PN: US6093797 PAGE: 15 claimed protein;2: PN:WO2009039992 PAGE: 107 claimed sequence;7-9-Oxytocin;L-Proline-L-leucine-glycine-amide;L-Prolyl-L-leucyl-glycine amide;L-Prolyl-L-leucylglycinamide;L-Prolyl-L-leucylglycylamide;MIF-I;MSH-releaseinhibiting factor I;Melanocyte-stimulating hormone release-inhibiting factor I(ox);Melanostatin I (ox);Oxytocin C-terminal tripeptide;Prolyleucyl-glycinamide;Prolylleucylglycine amide;H-Pro-Leu-Gly-NH2; |
| EINECS: | 217-902-7 |
| Density: | 1.147 g/cm3 |
| Melting Point: | 122-123 °C(Solv: water (7732-18-5)) |
| Boiling Point: | 626.2 °C at 760 mmHg |
| Flash Point: | 332.5 °C |
| Solubility: | Soluble in water. |
| PSA: | 113.32000 |
| LogP: | 0.68170 |
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Specification
The CAS register number of Glycinamide,L-prolyl-L-leucyl- is 2002-44-0. It also can be called as 2-Pyrrolidinecarboxamide, N-(1-((carbamoylmethyl)carbamoyl)-3-methylbutyl)- and the IUPAC name about this chemical is (2S)-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]pyrrolidine-2-carboxamide. The molecular formula about this chemical is C13H24N4O3 and the molecular weight is 284.35. It belongs to the following product categories which include Melanocortin receptor; Peptide and so on.
Physical properties about Glycinamide,L-prolyl-L-leucyl- are: (1)ACD/LogP: -1.07; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -4.05; (4)ACD/LogD (pH 7.4): -2.75; (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: 7; (10)#H bond donors: 5; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 64.17Å2; (13)Index of Refraction: 1.51; (14)Molar Refractivity: 74.13 cm3; (15)Molar Volume: 247.8 cm3; (16)Polarizability: 29.38x10-24cm3; (17)Surface Tension: 45.8 dyne/cm; (18)Flash Point: 332.5 °C; (19)Enthalpy of Vaporization: 92.7 kJ/mol; (20)Boiling Point: 626.2 °C at 760 mmHg; (21)Vapour Pressure: 1.34E-15 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(N[C@H](C(=O)NCC(=O)N)CC(C)C)[C@H]1NCCC1
(2)InChI: InChI=1/C13H24N4O3/c1-8(2)6-10(12(19)16-7-11(14)18)17-13(20)9-4-3-5-15-9/h8-10,15H,3-7H2,1-2H3,(H2,14,18)(H,16,19)(H,17,20)/t9-,10-/m0/s1
(3)InChIKey: NOOJLZTTWSNHOX-UWVGGRQHBY
(4)Std. InChI: InChI=1S/C13H24N4O3/c1-8(2)6-10(12(19)16-7-11(14)18)17-13(20)9-4-3-5-15-9/h8-10,15H,3-7H2,1-2H3,(H2,14,18)(H,16,19)(H,17,20)/t9-,10-/m0/s1
(5)Std. InChIKey: NOOJLZTTWSNHOX-UWVGGRQHSA-N