CS-0874742
rel-(4aR,6S,7R,8S,8aR)-2-acetamido-8a-acetyl-6,7-dihydroxy-6-methyl-4-oxo-1,4,4a,5,6,7,8,8a-octahydroquinazolin-8-yl acetate
Manufacturer: ChemScene
CAS Number: 87067-99-0
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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
C₁₅H₂₁N₃O₇
Molecular Weight
355.34
Synonyms
None
SMILES
CC([C@@]12[C@@](C(N=C(N2)NC(C)=O)=O)([H])C[C@](O)([C@@H]([C@H]1OC(C)=O)O)C)=O
Tpsa
154.39
Logp
-2.0004
H Acceptors
8
H Donors
4
Rotatable Bonds
2
SAFETY INFORMATION
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: C₁₅H₂₁N₃O₇
Molecular Weight: 355.34
Synonyms: None
SMILES: CC([C@@]12[C@@](C(N=C(N2)NC(C)=O)=O)([H])C[C@](O)([C@@H]([C@H]1OC(C)=O)O)C)=O
Tpsa: 154.39
Logp: -2.0004
H Acceptors: 8
H Donors: 4
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₁N₃O₇
Molecular Weight:
355.34
Synonyms:
None
SMILES:
CC([C@@]12[C@@](C(N=C(N2)NC(C)=O)=O)([H])C[C@](O)([C@@H]([C@H]1OC(C)=O)O)C)=O
Tpsa:
154.39
Logp:
-2.0004
H Acceptors:
8
H Donors:
4
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₉FO₂S
Molecular Weight: 200.23
Synonyms: None
SMILES: CCOC(=O)C1=C(C=CC(=C1)F)S
Tpsa: 26.3
Logp: 2.2911
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₉FO₂S
Molecular Weight:
200.23
Synonyms:
None
SMILES:
CCOC(=O)C1=C(C=CC(=C1)F)S
Tpsa:
26.3
Logp:
2.2911
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₅NO₆
Molecular Weight: 269.25
Synonyms: None
SMILES: CCOC(=O)C1=C2C(=C(N1)C(=O)OCC)OCCO2
Tpsa: 86.85
Logp: 1.1393
H Acceptors: 6
H Donors: 1
Rotatable Bonds: 4
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₅NO₆
Molecular Weight:
269.25
Synonyms:
None
SMILES:
CCOC(=O)C1=C2C(=C(N1)C(=O)OCC)OCCO2
Tpsa:
86.85
Logp:
1.1393
H Acceptors:
6
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: C₁₃H₁₇NO₆
Molecular Weight: 283.28
Synonyms: None
SMILES: CCOC(=O)C1=C2C(=C(N1)C(=O)OCC)OCCCO2
Tpsa: 86.85
Logp: 1.5294
H Acceptors: 6
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:
C₁₃H₁₇NO₆
Molecular Weight:
283.28
Synonyms:
None
SMILES:
CCOC(=O)C1=C2C(=C(N1)C(=O)OCC)OCCCO2
Tpsa:
86.85
Logp:
1.5294
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
4