CS-1002283
Remdesivir Impurity 26
Manufacturer: ChemScene
CAS Number: 1884576-18-4
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Purity
97%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₃₀H₃₉N₆O₈P
Molecular Weight
642.64
Synonyms
None
SMILES
C(#N)[C@@]1([C@]2([C@@]([C@@H](COP(OC3=CC=CC=C3)(N[C@H](C(OCC(CC)CC)=O)C)=O)O1)(OC(C)(C)O2)[H])[H])C=4N5C(=CC4)C(N)=NC=N5
Tpsa
181.55
Logp
4.11048
H Acceptors
13
H Donors
2
Rotatable Bonds
13
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: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₀H₃₉N₆O₈P
Molecular Weight: 642.64
Synonyms: None
SMILES: C(#N)[C@@]1([C@]2([C@@]([C@@H](COP(OC3=CC=CC=C3)(N[C@H](C(OCC(CC)CC)=O)C)=O)O1)(OC(C)(C)O2)[H])[H])C=4N5C(=CC4)C(N)=NC=N5
Tpsa: 181.55
Logp: 4.11048
H Acceptors: 13
H Donors: 2
Rotatable Bonds: 13
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₀H₃₉N₆O₈P
Molecular Weight:
642.64
Synonyms:
None
SMILES:
C(#N)[C@@]1([C@]2([C@@]([C@@H](COP(OC3=CC=CC=C3)(N[C@H](C(OCC(CC)CC)=O)C)=O)O1)(OC(C)(C)O2)[H])[H])C=4N5C(=CC4)C(N)=NC=N5
Tpsa:
181.55
Logp:
4.11048
H Acceptors:
13
H Donors:
2
Rotatable Bonds:
13
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₂₄N₂O₃S
Molecular Weight: 372.48
Synonyms: None
SMILES: O=C(S)CCC(=O)NC1=CC=C(C=C1)CCNCC(O)C=2C=CC=CC2
Tpsa: 78.43
Logp: 2.7274
H Acceptors: 4
H Donors: 4
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:
C₂₀H₂₄N₂O₃S
Molecular Weight:
372.48
Synonyms:
None
SMILES:
O=C(S)CCC(=O)NC1=CC=C(C=C1)CCNCC(O)C=2C=CC=CC2
Tpsa:
78.43
Logp:
2.7274
H Acceptors:
4
H Donors:
4
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: C₁₆H₂₀N₂O
Molecular Weight: 256.34
Synonyms: None
SMILES: OC(NCCC1=CC=C(N)C=C1)CC=2C=CC=CC2
Tpsa: 58.28
Logp: 1.962
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₀N₂O
Molecular Weight:
256.34
Synonyms:
None
SMILES:
OC(NCCC1=CC=C(N)C=C1)CC=2C=CC=CC2
Tpsa:
58.28
Logp:
1.962
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₂₄N₂O₃S
Molecular Weight: 384.49
Synonyms: None
SMILES: N(C(/C=C\C(OC)=S)=O)C1=CC=C(CCNCC(O)C2=CC=CC=C2)C=C1
Tpsa: 70.59
Logp: 3.0208
H Acceptors: 5
H Donors: 3
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₄N₂O₃S
Molecular Weight:
384.49
Synonyms:
None
SMILES:
N(C(/C=C\C(OC)=S)=O)C1=CC=C(CCNCC(O)C2=CC=CC=C2)C=C1
Tpsa:
70.59
Logp:
3.0208
H Acceptors:
5
H Donors:
3
Rotatable Bonds:
9