CS-0533532
(4S,4'S)-4,4'-((2,2'-(4-(Dimethylamino)butane-1,1-diyl)bis(3-(2-(dimethylamino)ethyl)-1H-indole-5,2-diyl))bis(methylene))bis(oxazolidin-2-one) Zolmitriptan Impurity
Manufacturer: ChemScene
CAS Number: 1350928-05-0
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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
C₃₈H₅₃N₇O₄
Molecular Weight
671.87
Synonyms
Zolmitriptan Related Compound F (2,2'-[4-(Dimethylamino)butane-1,1-diyl]bis{5-[(S)-(2-oxooxazolidin-4-yl)methyl]-3-(2-dimethylaminoethyl)indole})
SMILES
CN(C)CCCC(C1=C(C2=CC(C[C@H]3COC(N3)=O)=CC=C2N1)CCN(C)C)C4=C(C5=CC(C[C@H]6COC(N6)=O)=CC=C5N4)CCN(C)C
Tpsa
117.96
Logp
4.6329
H Acceptors
7
H Donors
4
Rotatable Bonds
16
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1350928-05-0 | Zolmitriptan Related Compound F | A2B Chem | ₹ 95,228.28 |
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: C₃₈H₅₃N₇O₄
Molecular Weight: 671.87
Synonyms: Zolmitriptan Related Compound F (2,2'-[4-(Dimethylamino)butane-1,1-diyl]bis{5-[(S)-(2-oxooxazolidin-4-yl)methyl]-3-(2-dimethylaminoethyl)indole})
SMILES: CN(C)CCCC(C1=C(C2=CC(C[C@H]3COC(N3)=O)=CC=C2N1)CCN(C)C)C4=C(C5=CC(C[C@H]6COC(N6)=O)=CC=C5N4)CCN(C)C
Tpsa: 117.96
Logp: 4.6329
H Acceptors: 7
H Donors: 4
Rotatable Bonds: 16
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₈H₅₃N₇O₄
Molecular Weight:
671.87
Synonyms:
Zolmitriptan Related Compound F (2,2'-[4-(Dimethylamino)butane-1,1-diyl]bis{5-[(S)-(2-oxooxazolidin-4-yl)methyl]-3-(2-dimethylaminoethyl)indole})
SMILES:
CN(C)CCCC(C1=C(C2=CC(C[C@H]3COC(N3)=O)=CC=C2N1)CCN(C)C)C4=C(C5=CC(C[C@H]6COC(N6)=O)=CC=C5N4)CCN(C)C
Tpsa:
117.96
Logp:
4.6329
H Acceptors:
7
H Donors:
4
Rotatable Bonds:
16
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₂₄N₂O₆
Molecular Weight: 304.34
Synonyms: None
SMILES: C[C@H]1CNC[C@@H](N1C(OC(C)(C)C)=O)C.O=C(O)C(O)=O
Tpsa: 116.17
Logp: 0.7593
H Acceptors: 5
H Donors: 3
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₂₄N₂O₆
Molecular Weight:
304.34
Synonyms:
None
SMILES:
C[C@H]1CNC[C@@H](N1C(OC(C)(C)C)=O)C.O=C(O)C(O)=O
Tpsa:
116.17
Logp:
0.7593
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₂₈O₂
Molecular Weight: 312.45
Synonyms: Pregna-4,14-diene-3,20-dione
SMILES: C[C@@]12[C@]3([H])[C@](CCC1=CC(CC2)=O)([H])C4=CC[C@H](C(C)=O)[C@]4(CC3)C
Tpsa: 34.14
Logp: 4.6436
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₈O₂
Molecular Weight:
312.45
Synonyms:
Pregna-4,14-diene-3,20-dione
SMILES:
C[C@@]12[C@]3([H])[C@](CCC1=CC(CC2)=O)([H])C4=CC[C@H](C(C)=O)[C@]4(CC3)C
Tpsa:
34.14
Logp:
4.6436
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₃NO
Molecular Weight: 127.18
Synonyms: None
SMILES: O=C1CNC(C)(C)CC1
Tpsa: 29.1
Logp: 0.7175
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₃NO
Molecular Weight:
127.18
Synonyms:
None
SMILES:
O=C1CNC(C)(C)CC1
Tpsa:
29.1
Logp:
0.7175
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0