CS-1002805
Nicergoline Impurity 23(Ssr)
Manufacturer: ChemScene
CAS Number: 2238859-47-5
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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
C₂₄H₂₆BrN₃O₃
Molecular Weight
484.39
Synonyms
None
SMILES
O(C)[C@]12C=3C=4C(C[C@@]1(N(C)C[C@@H](COC(=O)C=5C=C(Br)C=NC5)C2)[H])=CN(C)C4C=CC3
Tpsa
56.59
Logp
3.9109
H Acceptors
6
H Donors
0
Rotatable Bonds
4
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: C₂₄H₂₆BrN₃O₃
Molecular Weight: 484.39
Synonyms: None
SMILES: O(C)[C@]12C=3C=4C(C[C@@]1(N(C)C[C@@H](COC(=O)C=5C=C(Br)C=NC5)C2)[H])=CN(C)C4C=CC3
Tpsa: 56.59
Logp: 3.9109
H Acceptors: 6
H Donors: 0
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:
C₂₄H₂₆BrN₃O₃
Molecular Weight:
484.39
Synonyms:
None
SMILES:
O(C)[C@]12C=3C=4C(C[C@@]1(N(C)C[C@@H](COC(=O)C=5C=C(Br)C=NC5)C2)[H])=CN(C)C4C=CC3
Tpsa:
56.59
Logp:
3.9109
H Acceptors:
6
H Donors:
0
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: C₁₈H₁₅NO₄S
Molecular Weight: 341.38
Synonyms: None
SMILES: O=CC=1C=C(C2=CC=C(C=C2)S(=O)(=O)C)C(O)=C3C=NC(=CC13)C
Tpsa: 84.33
Logp: 3.13182
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₁₅NO₄S
Molecular Weight:
341.38
Synonyms:
None
SMILES:
O=CC=1C=C(C2=CC=C(C=C2)S(=O)(=O)C)C(O)=C3C=NC(=CC13)C
Tpsa:
84.33
Logp:
3.13182
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₆H₄₂O₄
Molecular Weight: 418.61
Synonyms: None
SMILES: C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@]([C@@H](CCC(O)=O)C)(CC4)[H])[H])([C@@H](O)C(=CC)[C@@]1(C[C@H](O)CC2)[H])[H])[H]
Tpsa: 77.76
Logp: 5.0341
H Acceptors: 3
H Donors: 3
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:
C₂₆H₄₂O₄
Molecular Weight:
418.61
Synonyms:
None
SMILES:
C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@]([C@@H](CCC(O)=O)C)(CC4)[H])[H])([C@@H](O)C(=CC)[C@@]1(C[C@H](O)CC2)[H])[H])[H]
Tpsa:
77.76
Logp:
5.0341
H Acceptors:
3
H Donors:
3
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: C₁₁H₁₃ClO
Molecular Weight: 196.67
Synonyms: None
SMILES: O=C(C1=CC(=CC=C1C)C)CCCl
Tpsa: 17.07
Logp: 3.11504
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₃ClO
Molecular Weight:
196.67
Synonyms:
None
SMILES:
O=C(C1=CC(=CC=C1C)C)CCCl
Tpsa:
17.07
Logp:
3.11504
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
3