CS-0914381
((3R,5R,E)-7-(4-(4-fluorophenyl)-6-isopropyl-2-(N-methylmethylsulfonamido)pyrimidin-5-yl)-3,5-dihydroxyhept-6-enoate) calcium(II)
Manufacturer: ChemScene
CAS Number: 1422515-55-6
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₂H₂₈CaFN₃O₆S
Molecular Weight
521.62
Synonyms
None
SMILES
OC(C[C@H](O)C[C@@H](O)/C=C/C1=C(C(C)C)N=C(N(C)S(C)(=O)=O)N=C1C2=CC=C(C=C2)F)=O.[Ca].[0.5]
Tpsa
140.92
Logp
2.0209
H Acceptors
7
H Donors
3
Rotatable Bonds
10
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1422515-55-6 | Calcium (3R,5R,6E)-7-[4-(4-fluorophenyl)-6-(1-methylethyl)-2-[methyl(methylsulfonyl)amino]-5-pyrimidinyl]-3,5-dihydroxy-6-heptenoate (1:2) | A2B Chem | ₹ 8,641.56 - ₹ 1,07,035.56 |
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₂₈CaFN₃O₆S
Molecular Weight: 521.62
Synonyms: None
SMILES: OC(C[C@H](O)C[C@@H](O)/C=C/C1=C(C(C)C)N=C(N(C)S(C)(=O)=O)N=C1C2=CC=C(C=C2)F)=O.[Ca].[0.5]
Tpsa: 140.92
Logp: 2.0209
H Acceptors: 7
H Donors: 3
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₂₈CaFN₃O₆S
Molecular Weight:
521.62
Synonyms:
None
SMILES:
OC(C[C@H](O)C[C@@H](O)/C=C/C1=C(C(C)C)N=C(N(C)S(C)(=O)=O)N=C1C2=CC=C(C=C2)F)=O.[Ca].[0.5]
Tpsa:
140.92
Logp:
2.0209
H Acceptors:
7
H Donors:
3
Rotatable Bonds:
10
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₈O₆
Molecular Weight: 246.26
Synonyms: None
SMILES: C(C(O)=O)[C@@H]1OC(C)(C)O[C@H](COC(C)=O)C1
Tpsa: 82.06
Logp: 0.9344
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₈O₆
Molecular Weight:
246.26
Synonyms:
None
SMILES:
C(C(O)=O)[C@@H]1OC(C)(C)O[C@H](COC(C)=O)C1
Tpsa:
82.06
Logp:
0.9344
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
4
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₂₆CaFN₃O₆S
Molecular Weight: 519.60
Synonyms: None
SMILES: C(=C/C(C[C@H](CC(O)=O)O)=O)\C=1C(=NC(N(S(C)(=O)=O)C)=NC1C(C)C)C2=CC=C(F)C=C2.[Ca]
Tpsa: 137.76
Logp: 2.2291
H Acceptors: 7
H Donors: 2
Rotatable Bonds: 10
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₂₆CaFN₃O₆S
Molecular Weight:
519.60
Synonyms:
None
SMILES:
C(=C/C(C[C@H](CC(O)=O)O)=O)\C=1C(=NC(N(S(C)(=O)=O)C)=NC1C(C)C)C2=CC=C(F)C=C2.[Ca]
Tpsa:
137.76
Logp:
2.2291
H Acceptors:
7
H Donors:
2
Rotatable Bonds:
10
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₇NO₁₀S₂
Molecular Weight: 459.45
Synonyms: None
SMILES: O=C(OC)C1=CC(=CC=C1OC)S(=O)(=O)OC2=CC=C(C=C2C(=O)OC)S(=O)(=O)N
Tpsa: 165.36
Logp: 0.6835
H Acceptors: 10
H Donors: 1
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₇NO₁₀S₂
Molecular Weight:
459.45
Synonyms:
None
SMILES:
O=C(OC)C1=CC(=CC=C1OC)S(=O)(=O)OC2=CC=C(C=C2C(=O)OC)S(=O)(=O)N
Tpsa:
165.36
Logp:
0.6835
H Acceptors:
10
H Donors:
1
Rotatable Bonds:
7